SCHEMBL988798

SCHEMBL988798

CCOC(=O)C(C#N)=Cc1ccc(Cl)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.71
MAPT P10636 7/20 0.71
KDM4E B2RXH2 5/20 0.71
PKM P14618 1/20 0.64
HTT P42858 1/20 0.64
KMT2A Q03164 4/20 0.63
MEN1 O00255 3/20 0.63
L3MBTL1 Q9Y468 2/20 0.63
TDP1 Q9NUW8 2/20 0.63
NPC1 O15118 1/20 0.63
MAPK1 P28482 1/20 0.63
CASP3 P42574 1/20 0.63
RAB9A P51151 1/20 0.63
SENP8 Q96LD8 1/20 0.63
SENP7 Q9BQF6 1/20 0.63
SENP6 Q9GZR1 1/20 0.63
PDCD1 Q15116 1/20 0.60
CD274 Q9NZQ7 1/20 0.60
CRHBP P24387 1/20 0.60
CRHR2 Q13324 1/20 0.60

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2576359 1.00 ALDH1A1 (0.71) ALDH1A1MAPTKDM4EPKMHTT
SCHEMBL2983002 1.00 ALDH1A1 (0.71) ALDH1A1MAPTKDM4EPKMHTT
SCHEMBL4317761 0.92 ALDH1A1 (0.81) ALDH1A1MAPTKDM4EPKMHTT
SCHEMBL2139678 0.92 ALDH1A1 (0.81) ALDH1A1MAPTKDM4EPKMHTT
SCHEMBL2139676 0.92 ALDH1A1 (0.81) ALDH1A1MAPTKDM4EPKMHTT
SCHEMBL21457264 0.89 TP53 (0.57) ALDH1A1MAPTKDM4EPKMHTT
SCHEMBL21457267 0.89 TP53 (0.57) ALDH1A1MAPTKDM4EPKMHTT
SCHEMBL20278911 0.88 ALDH1A1 (0.74) ALDH1A1MAPTKDM4EPKMHTT
SCHEMBL8998886 0.88 ALDH1A1 (0.74) ALDH1A1MAPTKDM4EPKMHTT
SCHEMBL8998890 0.88 ALDH1A1 (0.74) ALDH1A1MAPTKDM4EPKMHTT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060085922-A1 Oxidizing composition comprising at least one electrophilic monomer and at least one non-benzoquinone oxidant L'OREAL S.A. (FR) 2006-04-27 US claimed
EP-3553097-B1 COPOLYMER AND OPTICAL FILM USING SAME TOSOH CORP (JP) 2022-05-04 EP disclosed
US-11225540-B2 Copolymer and optical film using same TOSOH CORPORATION (JP) 2022-01-18 US disclosed
CN-110248971-B Copolymer and optical film using the same 东曹株式会社 2021-11-02 CN disclosed
CN-113416191-A Method for synthesizing tricyclic framework 2-pyridone/2-pyridine imine compound 西安交通大学 2021-09-21 CN disclosed
US-20200095358-A1 COPOLYMER AND OPTICAL FILM USING SAME TOSOH CORPORATION (JP) 2020-03-26 US disclosed
EP-3553097-A1 COPOLYMER AND OPTICAL FILM USING SAME Tosoh Corporation (JP) 2019-10-16 EP disclosed
US-9303040-B2 Substituted piperazines as AKT inhibitors ARRAY BIOPHARMA INC. (US) 2016-04-05 US disclosed
US-20120329808-A1 DIHYDROTHIENO PYRIMIDINES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2012-12-27 US disclosed
US-20120156270-A1 METHOD FOR SMOOTHING OUT THE SKIN BY FILLING IN RECESSED PORTIONS L'OREAL (FR) 2012-06-21 US disclosed
US-20060110334-A1 Two-compartment aerosol device comprising electrophilic monomers, and use thereof for the cosmetic treatment of the hair L'OREAL S.A. (FR) 2006-05-25 US disclosed
US-20060110350-A1 Composition comprising electrophilic monomers and particular organic salts, and use thereof for cosmetic treatment of keratin materials L'OREAL S.A. (FR) 2006-05-25 US disclosed
US-20060088493-A1 Composition and process for the cosmetic treatment of keratin materials based on electrophilic monomers and non-silicone polymers L'OREAL S.A. (FR) 2006-04-27 US disclosed
US-20060088488-A1 Dyeing composition comprising a mixture of at least one pigment and at least one electrophilic monomer L'OREAL S.A. (FR) 2006-04-27 US disclosed
US-20060085922-A1 Oxidizing composition comprising at least one electrophilic monomer and at least one non-benzoquinone oxidant L'OREAL S.A. (FR) 2006-04-27 US disclosed
US-20060083706-A1 Haircare composition comprising at least one electrophilic monomer and micro- or nanoparticles of at least one solid lubricant L'OREAL S.A. (FR) 2006-04-20 US disclosed
US-20060080792-A1 Film-forming composition for the cosmetic treatment of keratin materials comprising at least one electrophilic monomer and at least one non-silicone polymer L'OREAL S.A. (FR) 2006-04-20 US disclosed
US-20060083762-A1 Uses of compositions comprising electrophilic monomers and micro-particles or nanoparticles L'OREAL S.A. (FR) 2006-04-20 US disclosed
US-20060078523-A1 Composition comprising at least one electrophilic monomer and at least one acid in a cosmetically acceptable anhydrous medium, and use thereof for cosmetic treatment of the hair L'OREAL S.A. (FR) 2006-04-13 US disclosed
US-20060078522-A1 Composition for treating keratin materials comprising at least one electrophilic monomer and at least one salt L'OREAL S.A. (FR) 2006-04-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060110334-A1 Two-compartment aerosol device comprising electrophilic monomers, and use thereof for the cosmetic treatment of the hair POLR1C, TRPA1, GSTM2 ALDH1A1 492/4885MAPT 3321/4885KDM4E 4230/4885
US-20060088493-A1 Composition and process for the cosmetic treatment of keratin materials based on electrophilic monomers and non-silicone polymers KRT18, CUTA, MARK1 ALDH1A1 3552/4885MAPT 366/4885KDM4E 421/4885
US-20060083762-A1 Uses of compositions comprising electrophilic monomers and micro-particles or nanoparticles KRT18, PRKDC, ACP1 ALDH1A1 828/4885MAPT 355/4885KDM4E 3279/4885
US-20060085922-A1 Oxidizing composition comprising at least one electrophilic monomer and at least one non-benzoquinone oxidant KRT18, GPX4, NOX4 ALDH1A1 303/4885MAPT 2098/4885KDM4E 1870/4885
US-20060083706-A1 Haircare composition comprising at least one electrophilic monomer and micro- or nanoparticles of at least one solid lubricant MITF, CUTA, NACA ALDH1A1 43/4885MAPT 865/4885KDM4E 4498/4885
US-20120329808-A1 DIHYDROTHIENO PYRIMIDINES AS AKT PROTEIN KINASE INHIBITORS DTYMK, TK1, PIK3CA ALDH1A1 3262/4885MAPT 1799/4885KDM4E 2767/4885
US-20060078523-A1 Composition comprising at least one electrophilic monomer and at least one acid in a cosmetically acceptable anhydrous medium, and use thereof for cosmetic treatment of the hair HOGA1, OAT, SUCLG1 ALDH1A1 18/4885MAPT 1711/4885KDM4E 4551/4885
US-20060088488-A1 Dyeing composition comprising a mixture of at least one pigment and at least one electrophilic monomer KRT18, IK, DDR1 ALDH1A1 155/4885MAPT 248/4885KDM4E 4287/4885
US-20060110350-A1 Composition comprising electrophilic monomers and particular organic salts, and use thereof for cosmetic treatment of keratin materials KRT18, PRKDC, CUTA ALDH1A1 992/4885MAPT 119/4885KDM4E 2896/4885
US-20060078522-A1 Composition for treating keratin materials comprising at least one electrophilic monomer and at least one salt KRT18, DSG1, DSC1 ALDH1A1 1453/4885MAPT 215/4885KDM4E 2607/4885
US-20120156270-A1 METHOD FOR SMOOTHING OUT THE SKIN BY FILLING IN RECESSED PORTIONS EPAS1, PGF, PASK ALDH1A1 4610/4885MAPT 4165/4885KDM4E 1404/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.