SCHEMBL9302503

SCHEMBL9302503

CCCCCC(C)(C)c1cc(-n2nc3ccc(Sc4ccccc4)cc3n2)c(O)c(C(C)(C)CCCCC)c1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 17/20 0.34
CNR2 P34972 14/20 0.34
GPR18 Q14330 3/20 0.33
GPR55 Q9Y2T6 3/20 0.33
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL7142407 0.94 CNR1 (0.32) CNR1CNR2GPR18GPR55
SCHEMBL7148633 0.89 CNR2 (0.38) CNR1CNR2GPR18GPR55
SCHEMBL673359 0.87 CNR1 (0.40) CNR1CNR2GPR18GPR55NPC1
SCHEMBL9302498 0.86 NPC1 (0.33) NPC1RAB9A
SCHEMBL22289027 0.86 CNR1 (0.42) CNR1CNR2GPR18GPR55NPC1
SCHEMBL10416591 0.85 CNR2 (0.37) CNR1CNR2GPR18GPR55NPC1
SCHEMBL7143468 0.84 CNR1 (0.32) CNR1CNR2GPR18GPR55
SCHEMBL7149840 0.83 CNR1 (0.33) CNR1CNR2GPR18GPR55
SCHEMBL7145679 0.83 CNR1 (0.33) CNR1CNR2GPR18GPR55
SCHEMBL8861278 0.82 CNR1 (0.39) CNR1CNR2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5278314-A N-Phenol-substituted benzotriazoles CIBA-GEIGY CORPORATION (US) 1994-01-11 US claimed
EP-0576527-A1 5-THIO-SUBSTITUTED BENZOTRIAZOLE UV-ABSORBERS AND STABILIZED COMPOSITIONS Ciba SC Holding AG (CH) 1994-01-05 EP claimed
WO-1992014718-A1 5-THIO-SUBSTITUTED BENZOTRIAZOLE UV-ABSORBERS AND STABILIZED COMPOSITIONS CIBA-GEIGY AG (CH) 1992-09-03 WO claimed