SCHEMBL7387644

SCHEMBL7387644

Cn1cc(C(=O)C(=O)Cl)c2cc(OCc3ccccc3)ccc21

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.50
LTB4R Q15722 2/20 0.49
LTB4R2 Q9NPC1 2/20 0.49
MEN1 O00255 2/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
KMT2A Q03164 2/20 0.48
MAOB P27338 2/20 0.47
PLA2G2A P14555 1/20 0.47
CNR1 P21554 2/20 0.46
CNR2 P34972 2/20 0.46
PPARG P37231 2/20 0.45
PPARD Q03181 2/20 0.45
PPARA Q07869 2/20 0.45
AS3MT Q9HBK9 1/20 0.45
LMNA P02545 1/20 0.44
NR4A2 P43354 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
SCHEMBL7497382 0.93 CNR1 (0.48) SRD5A2LTB4RLTB4R2MEN1NPC1
SCHEMBL27732143 0.83 CNR1 (0.49) SRD5A2LTB4RLTB4R2MEN1NPC1
SCHEMBL5894096 0.81 PLA2G2A (0.56) LTB4RLTB4R2PLA2G2APPARGPPARD
SCHEMBL2433126 0.81 LTB4R (0.55) SRD5A2LTB4RLTB4R2MEN1KMT2A
SCHEMBL2085650 0.81 CNR1 (0.47) SRD5A2LTB4RLTB4R2MEN1NPC1
SCHEMBL7384942 0.80 ABCG2 (0.56) NR4A2
SCHEMBL6087231 0.80 PARP10 (0.49) SRD5A2LTB4RLTB4R2MEN1NPC1
SCHEMBL28995408 0.78 SRD5A2 (0.51) SRD5A2LTB4RLTB4R2MEN1NPC1
SCHEMBL2434205 0.78 NR4A2 (0.58) SRD5A2LTB4RLTB4R2NPC1RAB9A
SCHEMBL3203412 0.78 SERPINE1 (0.64) LTB4RLTB4R2MEN1KMT2APLA2G2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5192770-A Antiemetic, anxiolytic, cognition activator SYNTEX (U.S.A.) INC. (US) 1993-03-09 US disclosed
EP-0490263-A1 Alpha-oxoacetamide derivatives SYNTEX (U.S.A.) INC. (US) 1992-06-17 EP disclosed