SCHEMBL9065712

SCHEMBL9065712

CCCCCCCC(CC)(c1nc(=O)c2ccccc2o1)c1nc(=O)c2ccccc2o1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
FAAH O00519 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
ELANE P08246 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL9065717 0.99 CYP1A2 (0.41) CYP1A2CYP3A4CYP2C9CYP2C19FAAH
SCHEMBL3794258 0.89 NPC1 (0.41) CYP1A2CYP3A4CYP2C9CYP2C19ALDH1A1
SCHEMBL3787635 0.76 NPC1 (0.44) CYP1A2CYP3A4ALDH1A1MAPTELANE
SCHEMBL4536987 0.72 RAB9A (0.52) CYP1A2CYP3A4CYP2C9CYP2C19ALDH1A1
SCHEMBL9418052 0.67 NPC1 (0.49) CYP3A4CYP2C9CYP2C19ALDH1A1MAPT
SCHEMBL22898347 0.65 MAPT (0.41) FAAHALDH1A1LMNAMAPTNPC1
SCHEMBL2882726 0.65 NPC1 (0.58) CYP3A4ALDH1A1LMNAMAPTNPC1
SCHEMBL3533214 0.64 KDM4E (0.57) CYP3A4ALDH1A1LMNAMAPTELANE
SCHEMBL5707868 0.63 NPC1 (0.55) CYP1A2CYP3A4CYP2C9CYP2C19ALDH1A1
SCHEMBL28018621 0.62 SRC (0.55) CYP1A2CYP3A4CYP2C9CYP2C19ALDH1A1

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
EP-0737231-A1 THERMAL STABILIZED RESIN COMPOSITIONS KOLON INDUSTRIES, INC. (KR) 1996-10-16 EP disclosed
WO-1995018181-A1 THERMAL STABILIZED RESIN COMPOSITIONS KOLON INDUSTRIES, INC. (KR) 1995-07-06 WO disclosed