SCHEMBL14252950

SCHEMBL14252950

CB(O)N1CCC(=C(c2ccccc2)c2cncc(CO)c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SETD7 Q8WTS6 1/20 0.43
▸ FNTA P49354 1/20 0.40
▸ FNTB P49356 1/20 0.40
▸ OPRD1 P41143 3/20 0.36
▸ OPRK1 P41145 1/20 0.34
▸ KCNH2 Q12809 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ CHRM2 P08172 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CHRM1 P11229 1/20 0.34
▸ CHRM3 P20309 1/20 0.34
▸ HTR2A P28223 1/20 0.34
▸ HRH1 P35367 1/20 0.34
▸ HTR2B P41595 1/20 0.34
▸ CHRNA4 P43681 1/20 0.34
▸ HTR3A P46098 1/20 0.34
▸ OPRM1 P35372 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
SCHEMBL14252825 0.85 SETD7 (0.47) SETD7FNTAFNTBOPRD1OPRK1
SCHEMBL14262776 0.85 SETD7 (0.61) SETD7FNTAFNTBOPRD1OPRK1
SCHEMBL12777874 0.81 FNTA (0.50) SETD7FNTAFNTBOPRD1OPRK1
SCHEMBL12751049 0.79 FNTA (0.51) SETD7FNTAFNTBOPRD1OPRK1
SCHEMBL1473049 0.76 FNTA (0.46) FNTAFNTB
SCHEMBL14252821 0.75 SETD7 (0.42) SETD7FNTAFNTBOPRD1KCNH2
SCHEMBL12751047 0.75 SETD7 (0.42) SETD7FNTAFNTBOPRD1OPRK1
SCHEMBL14252952 0.74 SETD7 (0.51) SETD7FNTAFNTBOPRD1OPRK1
SCHEMBL14252827 0.74 SETD7 (0.50) SETD7FNTAFNTBOPRD1OPRK1
SCHEMBL14252954 0.73 SETD7 (0.47) SETD7FNTAFNTBOPRD1OPRK1

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-7348337-B2 Indole, azaindole and related heterocyclic 4-alkenyl piperidine amides BRISTOL-MYERS SQUIBB COMPANY (US) 2008-03-25 — — US disclosed
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