SCHEMBL367639

SCHEMBL367639

C=CC([C]=O)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.38
KDM4E B2RXH2 4/20 0.38
MAPT P10636 4/20 0.38
CYP3A4 P08684 3/20 0.38
ALOX15 P16050 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 4/20 0.35
CYP2D6 P10635 1/20 0.34
SRC P12931 1/20 0.34
HPGD P15428 3/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
USP2 O75604 2/20 0.33
TP53 P04637 2/20 0.33
HSD17B10 Q99714 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
DPP4 P27487 2/20 0.33
MAPK1 P28482 1/20 0.33
ALOX12 P18054 1/20 0.33
F2 P00734 1/20 0.33

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
SCHEMBL9161043 0.80 MAPT (0.42) CYP2C19KDM4EMAPTCYP3A4ALOX15
SCHEMBL5391094 0.79 CYP2D6 (0.41) LMNACYP2D6SRCALDH1A1TSHR
SCHEMBL11044108 0.78 IDO1 (0.34) SMN1; SMN2LMNAHPGDALDH1A1USP2
SCHEMBL1052816 0.77 TSHR (0.46) CYP2C19KDM4EMAPTCYP3A4ALOX15
SCHEMBL5433742 0.77 SMN1; SMN2 (0.35) CYP2C19KDM4EMAPTCYP3A4ALOX15
SCHEMBL2007288 0.71 KDM4E (0.53) CYP2C19KDM4EMAPTCYP3A4ALOX15
SCHEMBL14938901 0.70 LMNA (0.38) CYP2C19CYP3A4LMNACYP2D6ALDH1A1
SCHEMBL8583801 0.69 CYP2C19 (0.42) CYP2C19KDM4EMAPTCYP3A4ALOX15
SCHEMBL250378 0.69 CYP2C19 (0.42) CYP2C19KDM4EMAPTCYP3A4ALOX15
SCHEMBL17075265 0.69 CYP2C19 (0.42) CYP2C19KDM4EMAPTCYP3A4ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103200936-A Novel N-hydroxybenzamide compounds for the treatment of cancer HOFFMANN LA ROCHE 2013-07-10 CN claimed
CN-102186809-A Insecticidal 4-phenyl-1h-pyrazoles BAYER CROPSCIENCE AG 2011-09-14 CN claimed
EP-2348841-A1 METHOD FOR IMPROVING PLANT HEALTH BASF SE (DE) 2011-08-03 EP claimed
EP-2348849-A1 METHOD FOR IMPROVING PLANT HEALTH BASF SE (DE) 2011-08-03 EP claimed
CN-101965351-A Benzofuran pyrimidinones EXELIXIS INC 2011-02-02 CN claimed
WO-2010049405-A1 METHOD FOR IMPROVING PLANT HEALTH BASF SE (DE) 2010-05-06 WO claimed
US-20100113770-A1 O-SUBSTITUTED HYDROXYARYL DERIVATIVES INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2010-05-06 US claimed
WO-2010049414-A1 METHOD FOR IMPROVING PLANT HEALTH BASF SE (DE) 2010-05-06 WO claimed
CN-101027294-A Phenyl DIAZEPAN carboxamides and annelated phenyl piperazine carboxamides containing oxygen and used as dopamine D3 antagonists SANOL ARZNEI SCHWARZ GMBH (DE) 2007-08-29 CN claimed
EP-1791825-A1 BENZOYL-SUBSTITUTED SERINE AMIDES BASF AKTIENGESELLSCHAFT (DE) 2007-06-06 EP claimed
CN-1107144-A Substituted heterocyclic carboxamide esters, their preparation and their use as pharmaceuticals HOECHST AG (DE) 1995-08-23 CN claimed
WO-1994022859-A1 SUBSTITUTED HETEROANNULATED IMIDAZOLES AND THEIR USE AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1994-10-13 WO claimed
CN-1061414-A HETEROAROYL DERIVATIVES OF MONOCYCLIC BETA-LACTAM ANTIBIOTICS SQUIBB & SONS INC (US) 1992-05-27 CN claimed
EP-0420069-A2 Heterocyclic hydrazide derivatives of monocyclic beta-lactam antibiotics E.R. SQUIBB & SONS, INC. (US) 1991-04-03 EP claimed
EP-0114658-B1 ALKYL-SUBSTITUTED 4-METHYL-PIPERIDINE DERIVATIVES AND USE THEREOF AS STABILIZERS AUSIMONT S.p.A. (IT) 1988-07-27 EP claimed
EP-0254078-A1 Pyran derivatives BASF Aktiengesellschaft (DE) 1988-01-27 EP claimed
US-4621110-A Alkyl-substituted 4-methyl-piperidine derivatives and use thereof as stabilizers MONTEDISON S.P.A. (IT) 1986-11-04 US claimed
EP-0114658-A1 Alkyl-substituted 4-methyl-piperidine derivatives and use thereof as stabilizers AUSIMONT S.p.A. (IT) 1984-08-01 EP claimed
US-4289847-A 2-EQUIVALENT YELLOW COUPLER KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1981-09-15 US claimed
US-4078061-A ANDROSTENONES RICHARDSON-MERRELL INC. (US) 1978-03-07 US claimed

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

For each of this compound's patents that has machine-readable text (1 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-20100113770-A1 O-SUBSTITUTED HYDROXYARYL DERIVATIVES RELA, NFKBIA, NFE2 CYP2C19 3634/4885KDM4E 2219/4885MAPT 4188/4885

“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.