SCHEMBL9252941

SCHEMBL9252941

CC1CN(C(c2ccccc2)c2ccccc2)C(C)C[N]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 4/20 0.48
▸ OPRL1 P41146 4/20 0.39
▸ OPRM1 P35372 4/20 0.39
▸ SLC6A9 P48067 1/20 0.38
▸ OPRK1 P41145 2/20 0.36
▸ CHRM2 P08172 1/20 0.36
▸ CHRM4 P08173 1/20 0.36
▸ CHRM5 P08912 1/20 0.36
▸ ADRA2A P08913 1/20 0.36
▸ ADORA3 P0DMS8 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ CHRM3 P20309 1/20 0.36
▸ DRD1 P21728 1/20 0.36
▸ ADRA1D P25100 1/20 0.36
▸ HTR2A P28223 1/20 0.36
▸ HTR2C P28335 1/20 0.36
▸ HRH1 P35367 1/20 0.36
▸ DRD3 P35462 1/20 0.36
▸ HTR2B P41595 1/20 0.36

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
SCHEMBL9253427 0.91 OPRD1 (0.42) OPRD1OPRL1OPRM1OPRK1SIGMAR1
SCHEMBL9253418 0.86 OPRL1 (0.40) OPRD1OPRL1OPRM1SLC6A9OPRK1
SCHEMBL9256532 0.84 SIGMAR1 (0.38) OPRD1OPRL1OPRM1OPRK1CHRM1
SCHEMBL9256528 0.78 DGKA (0.34) OPRD1OPRL1OPRM1OPRK1CYP3A4
SCHEMBL13955139 0.72 OPRD1 (0.50) OPRD1OPRL1OPRM1SLC6A9OPRK1
SCHEMBL4499828 0.71 SIGMAR1 (0.52) OPRD1OPRL1OPRM1SLC6A9OPRK1
SCHEMBL16226345 0.70 OPRD1 (0.48) OPRD1OPRL1OPRM1SLC6A9OPRK1
SCHEMBL16227065 0.70 OPRD1 (0.48) OPRD1OPRL1OPRM1SLC6A9OPRK1
SCHEMBL13163119 0.69 OPRM1 (0.51) OPRD1OPRL1OPRM1SLC6A9OPRK1
SCHEMBL21787342 0.69 OPRM1 (0.51) OPRD1OPRL1OPRM1SLC6A9OPRK1

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
US-5470851-A Antihistamine, anticoagulants SANKYO COMPANY, LIMITED (JP) 1995-11-28 — — US disclosed
EP-0463873-A1 Thiazolidinecarboxylic acid amide derivatives having anti-allergic activity, their preparation and their use Sankyo Company Limited (JP) 1992-01-02 — — EP disclosed
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