SCHEMBL3485765

SCHEMBL3485765

CO/C(=C\c1ccccc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.55
ABCG2 Q9UNQ0 2/20 0.54
AKR1C1 Q04828 1/20 0.48
ALDH1A1 P00352 3/20 0.47
RECQL P46063 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HTT P42858 1/20 0.46
TSHR P16473 2/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL83065 1.00 AKR1C3 (0.55) AKR1C3ABCG2AKR1C1ALDH1A1RECQL
SCHEMBL3818255 1.00 AKR1C3 (0.55) AKR1C3ABCG2AKR1C1ALDH1A1RECQL
SCHEMBL8351839 0.98 AKR1C3 (0.53) AKR1C3ABCG2AKR1C1ALDH1A1RECQL
Hydrochloric Acid SCHEMBL10437231 0.98 AKR1C3 (0.53) AKR1C3ABCG2AKR1C1ALDH1A1RECQL
Ammonia Solution, Strong SCHEMBL4743624 0.98 ABCG2 (0.56) AKR1C3ABCG2AKR1C1ALDH1A1RECQL
Acrylic Acid SCHEMBL2468603 0.91 ABCG2 (0.48) AKR1C3ABCG2AKR1C1ALDH1A1RECQL
Cyanamide SCHEMBL5277769 0.89 MCL1 (0.47) AKR1C3ABCG2AKR1C1ALDH1A1RECQL
Tert-Butylbenzene SCHEMBL31552779 0.88 ABCG2 (0.46) AKR1C3ABCG2AKR1C1ALDH1A1RECQL
Monoethanolamine SCHEMBL30202395 0.88 ABCG2 (0.46) AKR1C3ABCG2AKR1C1ALDH1A1RECQL
SCHEMBL9103420 0.88 ABCG2 (0.54) AKR1C3ABCG2AKR1C1ALDH1A1RECQL

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114867776-A Coated aramid pulp for rubber reinforcement 巴斯夫欧洲公司 2022-08-05 CN disclosed
EP-2275398-B1 APPLICATION OF AN IRIDIUM COMPLEX IN ASYMMETRIC CATALYTIC HYDROGENATION OF AN UNSATURATED CARBOXYLIC ACID ZHEJIANG JIUZHOU PHARM CO LTD (CN) 2016-05-04 EP disclosed
US-8692018-B2 Application of iridium complexes in asymmetric catalytic hydrogenation of unsaturated carboxylic acids Zheijiang Jiuzhou Pharmaceutical Co., Ltd. (CN) 2014-04-08 US disclosed
US-8692018-B2 Application of iridium complexes in asymmetric catalytic hydrogenation of unsaturated carboxylic acids Zheijiang Jiuzhou Pharmaceutical Co., Ltd. (CN) 2014-04-08 US disclosed
US-20140056834-A1 COSMETIC COMPOSITION COMPRISING CHRYSOPHANOL AS ACTIVE INGREDIENT FOR SKIN WHITENING PUKYONG NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2014-02-27 US disclosed
EP-2561007-A1 PHOTOALIGNING MATERIAL Rolic AG (CH) 2013-02-27 EP disclosed
US-20110092732-A1 APPLICATION OF IRIDIUM COMPLEXES IN ASYMMETRIC CATALYTIC HYDROGENATION OF UNSATURATED CARBOXYLIC ACIDS Zheijiang Jiuzhou Pharmaceutical Co., Ltd. (CN) 2011-04-21 US disclosed
US-20110092732-A1 APPLICATION OF IRIDIUM COMPLEXES IN ASYMMETRIC CATALYTIC HYDROGENATION OF UNSATURATED CARBOXYLIC ACIDS Zheijiang Jiuzhou Pharmaceutical Co., Ltd. (CN) 2011-04-21 US disclosed
WO-2010118241-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASES INDIANA UNIVERSITY RESEARCH & TECHNOLOGY CORPORATION (US) 2010-10-14 WO disclosed
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors BROOKS DAWN A 2007-11-29 US disclosed
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US disclosed
US-20050020684-A1 Modulators of peroxisome proliferator activated receptors ELI LILLY AND COMPANY 2005-01-27 US disclosed
CN-1543451-A Receptor modulators activated by peroxizonal proliferators (ppar) 2004-11-03 CN disclosed
EP-1392637-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2004-03-03 EP disclosed
WO-2002100813-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2002-12-19 WO 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 (4 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-20110092732-A1 APPLICATION OF IRIDIUM COMPLEXES IN ASYMMETRIC CATALYTIC HYDROGENATION OF UNSATURATED CARBOXYLIC ACIDS HDHD5, ELOVL5, FASN AKR1C3 740/4885ABCG2 2157/4885AKR1C1 645/4885
US-20140056834-A1 COSMETIC COMPOSITION COMPRISING CHRYSOPHANOL AS ACTIVE INGREDIENT FOR SKIN WHITENING TYR, MITF, MC1R AKR1C3 1665/4885ABCG2 2178/4885AKR1C1 2385/4885
US-20050020684-A1 Modulators of peroxisome proliferator activated receptors NCOA4, PPARG, PPARA AKR1C3 389/4885ABCG2 1309/4885AKR1C1 659/4885
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors PPARG, NCOA4, PPARA AKR1C3 367/4885ABCG2 1215/4885AKR1C1 594/4885

“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.