SCHEMBL250270

SCHEMBL250270

C=CCOC(=O)/C=C\C(N)=O

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.69
CACNA1B Q00975 1/20 0.69
APBA1 Q02410 1/20 0.69
APP P05067 1/20 0.44
CYP3A4 P08684 3/20 0.38
TSHR P16473 7/20 0.37
ALDH1A1 P00352 6/20 0.37
HSD17B10 Q99714 3/20 0.37
NPSR1 Q6W5P4 2/20 0.37
RAB9A P51151 1/20 0.37
FGFR4 P22455 1/20 0.36
HCAR2 Q8TDS4 3/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
CYP2C9 P11712 1/20 0.33
TP53 P04637 3/20 0.31
HIF1A Q16665 2/20 0.31
KDM4E B2RXH2 1/20 0.30
HPGD P15428 1/20 0.30

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
Acrylamide SCHEMBL4363896 0.91 MAPT (0.69) MAPTCACNA1BAPBA1APPCYP3A4
Acrylamide SCHEMBL4363895 0.91 MAPT (0.69) MAPTCACNA1BAPBA1APPCYP3A4
SCHEMBL36140 0.89 MAPT (0.69) MAPTCACNA1BAPBA1APPCYP3A4
SCHEMBL6885967 0.89 MAPT (0.69) MAPTCACNA1BAPBA1APPCYP3A4
SCHEMBL36139 0.89 MAPT (0.69) MAPTCACNA1BAPBA1APPCYP3A4
SCHEMBL36375 0.89 MAPT (0.69) MAPTCACNA1BAPBA1APPCYP3A4
Ethylene SCHEMBL28241615 0.86 MAPT (0.67) MAPTCACNA1BAPBA1APPCYP3A4
SCHEMBL7809907 0.86 MAPT (0.67) MAPTCACNA1BAPBA1APPCYP3A4
SCHEMBL7809914 0.86 MAPT (0.67) MAPTCACNA1BAPBA1APPCYP3A4
SCHEMBL11245982 0.83 MAPT (0.63) MAPTCACNA1BAPBA1APPCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107936294-B A kind of N- cetyl maleamic acid-lanthanum (III)-shepardite compound 西安科技大学 2019-10-08 CN claimed
CN-107936294-A A kind of N cetyls maleamic acid lanthanum (III) shepardite compound 西安科技大学 2018-04-20 CN claimed
US-4915102-A Applying a film layer to the skin BERTEK, INC. (US) 1990-04-10 US claimed
US-4134815-A Amphoteric composite resins and method of preparing same by polymerization of a two-phase dispersion of monomers ICI AUSTRALIA LIMITED (AU) 1979-01-16 US claimed
EP-3980006-A2 TOPICAL TIME RELEASE DELIVERY USING LAYERED BIOPOLYMER Diomics Corporation (US) 2022-04-13 EP disclosed
CN-113061290-B Nitrogen heterocyclic ring rare earth stabilizer 常州佑佳新材料科技有限公司 2021-12-14 CN disclosed
CN-113061290-A Nitrogen heterocyclic ring rare earth stabilizer 常州佑佳新材料科技有限公司 2021-07-02 CN disclosed
EP-3116861-B1 SMALL MOLECULES FOR INHIBITING MALE FERTILITY UNIV NORTH CAROLINA CHAPEL HILL (US) 2020-12-16 EP disclosed
WO-2020247874-A2 TOPICAL TIME RELEASE DELIVERY USING LAYERED BIOPOLYMER DIOMICS CORPORATION (US) 2020-12-10 WO disclosed
US-20200188177-A1 DERMAL DEVICE FOR ADMINISTRATION OF ONE OR MORE ACTIVE AGENTS TO THE SKIN MYLAN INC. (US) 2020-06-18 US disclosed
US-10632195-B2 Pharmaceutical device for electric-field assisted administration of Tapentadol and method of administering Tapentadol with same GRUENENTHAL GMBH (DE) 2020-04-28 US disclosed
US-10472334-B2 Small molecules for inhibiting male fertility THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2019-11-12 US disclosed
US-4915102-A Applying a film layer to the skin BERTEK, INC. (US) 1990-04-10 US disclosed
EP-0356614-A2 Hinged dermal applicator MLI ACQUISITION CORP. II (US) 1990-03-07 EP disclosed
US-4707495-A PROSTAGLANDINS ORTHO PHARMACEUTICAL (US) 1987-11-17 US disclosed
EP-0225044-A1 Peptic ulcer treatment ORTHO PHARMACEUTICAL CORPORATION (US) 1987-06-10 EP disclosed
US-4666441-A Multicompartmentalized transdermal patches CIBA-GEIGY CORPORATION (US) 1987-05-19 US disclosed
US-4573996-A Device for the administration of an active agent to the skin or mucosa JONERGIN, INC. (US) 1986-03-04 US disclosed
EP-0008227-B1 PHARMACEUTICAL COMPOSITIONS FOR TOPICAL ADMINISTRATION CONTAINING PROSTAGLANDINS AMERICAN CYANAMID COMPANY (US) 1983-04-27 EP disclosed
US-4254145-A LOCALIZED VASOCILATION AMERICAN CYANAMID COMPANY (US) 1981-03-03 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 (2 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-10472334-B2 Small molecules for inhibiting male fertility ACR, SPAG5, NASP MAPT 4237/4885CACNA1B 3099/4885APBA1 4054/4885
US-10632195-B2 Pharmaceutical device for electric-field assisted administration of Tapentadol and method of administering Tapentadol with same SLC6A2, SLC9A2, ATP1A2 MAPT 2499/4885CACNA1B 125/4885APBA1 4662/4885

“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.