SCHEMBL7889803

SCHEMBL7889803

CCOC(=O)c1[nH]c(C)nc1C(=S)OCC

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
HPGD P15428 2/20 0.46
KDM4E B2RXH2 2/20 0.46
HTT P42858 1/20 0.46
RECQL P46063 1/20 0.46
CYP1A2 P05177 2/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
POLB P06746 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPT P10636 1/20 0.42
PPARG P37231 1/20 0.42
NCOA2 Q15596 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPK1 P28482 1/20 0.37
MC4R P32245 1/20 0.37
TSHR P16473 2/20 0.37

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
SCHEMBL7885220 0.86 ALDH1A1 (0.51) ALDH1A1HPGDKDM4EHTTRECQL
SCHEMBL7885590 0.84 ALDH1A1 (0.44) ALDH1A1HPGDKDM4EHTTRECQL
SCHEMBL2616850 0.78 ALDH1A1 (0.53) ALDH1A1HPGDKDM4EHTTRECQL
SCHEMBL24283847 0.75 ALDH1A1 (0.50) ALDH1A1HPGDKDM4EHTTRECQL
SCHEMBL3017016 0.75 ALDH1A1 (0.54) ALDH1A1HPGDKDM4EHTTRECQL
SCHEMBL7717792 0.74 ALDH1A1 (0.46) ALDH1A1HPGDKDM4EHTTRECQL
SCHEMBL11482936 0.74 CYP1A2 (0.47) ALDH1A1HPGDKDM4EHTTRECQL
SCHEMBL20295385 0.72 ALDH1A1 (0.47) ALDH1A1HPGDKDM4EHTTRECQL
SCHEMBL21771639 0.71 KDM4E (0.42) ALDH1A1HPGDKDM4EHTTRECQL
SCHEMBL8292169 0.71 ALDH1A1 (0.50) ALDH1A1HPGDKDM4EHTTRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0573218-B1 4-Carboxyimidazoles as angiotensin II antagonists and their thrapeutic use SANKYO CO (JP) 2001-03-07 EP disclosed
US-5646171-A HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 1997-07-08 US disclosed
US-5616599-A HYPOTENSIVE AGENTS FOR CARDIOVASCULAR DISORDER SANKYO COMPANY, LIMITED (JP) 1997-04-01 US disclosed
EP-0313724-B1 Bis (acyloxymethyl) imidazole Derivative UNIV NEW YORK STATE RES FOUND (US) 1995-08-09 EP disclosed
US-5329012-A Bactericides, fungicides or antitumor agents THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1994-07-12 US disclosed
EP-0573218-A2 4-Carboxyimidazoles as angiotensin II antagonists and their thrapeutic use SANKYO COMPANY LIMITED (JP) 1993-12-08 EP disclosed
EP-0313724-A2 Bis (acyloxymethyl) imidazole Derivative THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1989-05-03 EP disclosed