SCHEMBL8940994

SCHEMBL8940994

CCCCCC(C)(C)c1ccc2oc(-c3ccc(-c4nc5cc(C(C)(C)C)ccc5o4)c4ccccc34)nc2c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 17/20 0.43
CNR2 P34972 17/20 0.43
F2RL3 Q96RI0 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
GFER P55789 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL5708053 0.97 CNR1 (0.46) CNR1CNR2MEN1ALDH1A1MAPT
SCHEMBL29786696 0.86 MAPT (0.52) F2RL3NPC1RAB9AGFERMEN1
SCHEMBL5708046 0.86 MAPT (0.52) F2RL3NPC1RAB9AGFERMEN1
SCHEMBL8940990 0.84 MAPT (0.44) F2RL3NPC1RAB9AGFERMEN1
SCHEMBL5708051 0.80 MAPT (0.47) F2RL3NPC1RAB9AGFERMEN1
SCHEMBL5708124 0.79 F2RL3 (0.44) CNR1CNR2F2RL3NPC1RAB9A
SCHEMBL28618111 0.78 MAPT (0.65) F2RL3NPC1RAB9AGFERMEN1
SCHEMBL15257105 0.76 ALDH1A1 (0.42) F2RL3NPC1RAB9AGFERMEN1
SCHEMBL8940957 0.75 ESR1 (0.56) NPC1RAB9AGFERMEN1ALDH1A1
SCHEMBL8940834 0.75 ALDH1A1 (0.47) NPC1RAB9AMEN1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5518656-A BIS/ALKYLBENZOXAZOLYL/NAPHTHALENE OR 1,5-DIPHENYL-3-STYRYLPYRAZOLINE NIPPON CHEMICAL WORKS CO., LTD. (JP) 1996-05-21 US disclosed