SCHEMBL5144504

SCHEMBL5144504

COC(=O)C(N)Cc1ccc(O)c(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA2 P00918 9/20 0.51
ALDH1A1 P00352 1/20 0.51
SLC7A5 Q01650 3/20 0.49
LCK P06239 2/20 0.49
PTGS2 P35354 2/20 0.49
KDM4E B2RXH2 1/20 0.49
USP2 O75604 1/20 0.49
EGFR P00533 1/20 0.49
FYN P06241 1/20 0.49
ADORA3 P0DMS8 1/20 0.49
ALOX15 P16050 1/20 0.49
PTGS1 P23219 1/20 0.49
HTR2A P28223 1/20 0.49
RECQL P46063 1/20 0.49
HIF1A Q16665 1/20 0.49
HSD17B10 Q99714 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CA1 P00915 5/20 0.47
HSD17B2 P37059 2/20 0.43

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
SCHEMBL5144506 1.00 CA2 (0.51) CA2ALDH1A1SLC7A5LCKPTGS2
SCHEMBL15105379 1.00 CA2 (0.51) CA2ALDH1A1SLC7A5LCKPTGS2
SCHEMBL30611537 1.00 CA2 (0.51) CA2ALDH1A1SLC7A5LCKPTGS2
Hydrochloric Acid SCHEMBL7036906 0.99 ALDH1A1 (0.53) CA2ALDH1A1SLC7A5LCKPTGS2
Hydrochloric Acid SCHEMBL7036902 0.99 ALDH1A1 (0.53) CA2ALDH1A1SLC7A5LCKPTGS2
SCHEMBL3750842 0.88 PNMT (0.56) ALDH1A1SLC7A5PTGS2
SCHEMBL3750165 0.88 PNMT (0.56) ALDH1A1SLC7A5PTGS2
SCHEMBL3751585 0.88 PNMT (0.56) ALDH1A1SLC7A5PTGS2
SCHEMBL5146262 0.87 SLC7A5 (0.48) CA2ALDH1A1SLC7A5LCKPTGS2
Hydrochloric Acid SCHEMBL3750170 0.87 ALDH1A1 (0.55) ALDH1A1SLC7A5PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3655036-B1 COMPOSITIONS FOR TREATING STRESS-RELATED DISORDERS HOFFMAN TECH LLC (US) 2024-09-04 EP claimed
CN-116783212-A Compositions and methods for modulating cancer in non-human mammals 霍夫曼技术有限责任公司 2023-09-19 CN claimed
CN-114901272-A Sustained release preparation 霍夫曼技术有限责任公司 2022-08-12 CN claimed
EP-3060200-B1 TYROSINE DERIVATIVES AND COMPOSITIONS COMPRISING THEM TYME INC (US) 2021-05-26 EP claimed
CN-109195601-A Pharmaceutical composition for treating cancer 迪美公司 2019-01-11 CN claimed
CN-116783212-A Compositions and methods for modulating cancer in non-human mammals 霍夫曼技术有限责任公司 2023-09-19 CN disclosed
CN-111032089-A Compositions for treating stress-related disorders 霍夫曼技术公司 2020-04-17 CN disclosed
EP-1540341-A4 METHOD FOR DETERMINATION OF LIKELIHOOD OF OCCURRENCE OF PRETERM LABOR IN PREGNANT FEMALES UNIV ROCHESTER MEDICAL CT (US) 2007-01-10 EP disclosed
US-20060166295-A1 Method for determination of likelihood of occurrence of preterm labor in pregnant females NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2006-07-27 US disclosed
EP-1540341-A1 METHOD FOR DETERMINATION OF LIKELIHOOD OF OCCURRENCE OF PRETERM LABOR IN PREGNANT FEMALES The University of Rochester Medical Center (US) 2005-06-15 EP disclosed
WO-2004003555-A1 METHOD FOR DETERMINATION OF LIKELIHOOD OF OCCURRENCE OF PRETERM LABOR IN PREGNANT FEMALES UNIVERSITY OF ROCHESTER MEDICAL CENTER (US) 2004-01-08 WO disclosed