SCHEMBL5039752

SCHEMBL5039752

CCCCCCCCCCCCOc1ccc(C(=O)C(C)(C)O)cc1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.67
TSHR P16473 1/20 0.67
PLA2G4B P0C869 6/20 0.65
RARB P10826 3/20 0.61
PLA2G4A P47712 1/20 0.58
GAA P10253 2/20 0.57
NPC1 O15118 1/20 0.57
LMNA P02545 1/20 0.57
MAPT P10636 1/20 0.57
ALOX15 P16050 1/20 0.57
RAB9A P51151 1/20 0.57
HSD17B10 Q99714 1/20 0.57
THRA P10827 2/20 0.56
THRB P10828 2/20 0.56
NR5A1 Q13285 1/20 0.56

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
SCHEMBL2471277 1.00 TP53 (0.67) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL5045278 1.00 TP53 (0.67) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL10711491 1.00 TP53 (0.67) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL5047352 1.00 TP53 (0.67) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL10713224 0.95 TP53 (0.58) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL5039654 0.93 RARB (0.59) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL5047452 0.93 RARB (0.59) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL13246799 0.89 TP53 (0.69) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL13246802 0.89 TP53 (0.69) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL13246800 0.89 TP53 (0.69) TP53TSHRPLA2G4BRARBPLA2G4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1341823-B1 SURFACE-ACTIVE PHOTOINITIATORS CIBA HOLDING INC (CH) 2008-10-01 EP disclosed
US-7001644-B2 Surface-active photoinitiators CIBA SPECIALTY CHEMICALS CORP. (US) 2006-02-21 US disclosed
US-20040034115-A1 Surface-active photoinitiators IGM GROUP B.V. (NL) 2004-02-19 US disclosed
EP-1341823-A1 SURFACE-ACTIVE PHOTOINITIATORS Ciba SC Holding AG (CH) 2003-09-10 EP disclosed
WO-2002048202-A1 SURFACE-ACTIVE PHOTOINITIATORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2002-06-20 WO disclosed