SCHEMBL11375998

SCHEMBL11375998

CCOc1ccc(C(c2cccc(OC)c2)N2CCC(N)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 3/20 0.48
▸ OPRM1 P35372 2/20 0.48
▸ MGLL Q99685 1/20 0.44
▸ OPRK1 P41145 1/20 0.44
▸ OPRL1 P41146 1/20 0.44
▸ NPY2R P49146 1/20 0.43
▸ TSHR P16473 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ CACNA2D1 P54289 2/20 0.40
▸ CACNA1B Q00975 2/20 0.40
▸ CACNB1 Q02641 2/20 0.40
▸ CACNA1C Q13936 2/20 0.40
▸ CACNA1G O43497 1/20 0.40

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
SCHEMBL11368361 0.87 OPRM1 (0.56) OPRD1OPRM1MGLLOPRK1OPRL1
SCHEMBL11369302 0.86 MGLL (0.47) OPRD1OPRM1MGLLOPRK1OPRL1
SCHEMBL11381493 0.81 MEN1 (0.50) OPRD1OPRM1MGLLOPRK1OPRL1
SCHEMBL11368410 0.81 OPRD1 (0.42) OPRD1OPRM1MGLLOPRK1OPRL1
SCHEMBL11368406 0.81 OPRD1 (0.42) OPRD1OPRM1MGLLOPRK1OPRL1
SCHEMBL6979086 0.80 OPRM1 (0.51) OPRD1OPRM1MGLLOPRK1OPRL1
SCHEMBL11377370 0.78 SMN1; SMN2 (0.44) OPRD1OPRM1MGLLOPRK1OPRL1
SCHEMBL11374255 0.78 OPRM1 (0.45) OPRD1OPRM1OPRK1OPRL1TSHR
SCHEMBL11378101 0.77 MCHR1 (0.47) MAPT
SCHEMBL11370495 0.74 OPRM1 (0.50) OPRD1OPRM1OPRK1OPRL1MAPT

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-4267318-A 1-(Diarylmethyl)-4-piperidinamine and derivatives thereof G. D. SEARLE & CO. (US) 1981-05-12 — — US disclosed
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