SCHEMBL6674618

SCHEMBL6674618

CCCCCC(c1cccc2c1Cc1ccccc1-2)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.43
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
CYSLTR2 Q9NS75 7/20 0.35
CYSLTR1 Q9Y271 7/20 0.35
SIGMAR1 Q99720 2/20 0.35
SOAT1 P35610 1/20 0.34
CYP1A2 P05177 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C19 P33261 2/20 0.33
EGFR P00533 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTR7 P34969 1/20 0.33
HTR2B P41595 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33

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
SCHEMBL6676496 0.95 PNMT (0.44) PNMTNPC1RAB9ACYSLTR2CYSLTR1
SCHEMBL6675789 0.89 PNMT (0.46) PNMTNPC1RAB9ACYP1A2CYP2D6
SCHEMBL6677852 0.87 PNMT (0.36) PNMTNPC1RAB9ACYSLTR2CYSLTR1
SCHEMBL27675984 0.86 PNMT (0.41) PNMTNPC1RAB9ACYSLTR2CYSLTR1
SCHEMBL3031940 0.86 PNMT (0.41) PNMTNPC1RAB9ACYSLTR2CYSLTR1
SCHEMBL1610355 0.86 PNMT (0.41) PNMTNPC1RAB9ACYSLTR2CYSLTR1
SCHEMBL27594318 0.86 PNMT (0.41) PNMTNPC1RAB9ACYSLTR2CYSLTR1
SCHEMBL1611126 0.85 PNMT (0.40) PNMTNPC1RAB9ACYSLTR2CYSLTR1
SCHEMBL6673438 0.83 PNMT (0.37) PNMTNPC1RAB9ACYSLTR2CYSLTR1
SCHEMBL6674901 0.83 PNMT (0.49) PNMTNPC1RAB9ACYP1A2CYP2D6

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
EP-0963990-B1 PROCESS FOR PRODUCING CYCLOPENTADIENYL METAL SALTS AND PROCESS FOR PRODUCING CYCLOPENTADIENE DERIVATIVES BY UTILIZING THE SAME SUMITOMO CHEMICAL CO (JP) 2004-10-06 EP disclosed
US-6197990-B1 REACTING CYCLOPENTADIENE AND METAL HYDRIDE IN PRESENCE OF AMINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-03-06 US disclosed
EP-0963990-A1 PROCESS FOR PRODUCING CYCLOPENTADIENYL METAL SALTS AND PROCESS FOR PRODUCING CYCLOPENTADIENE DERIVATIVES BY UTILIZING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-12-15 EP disclosed