SCHEMBL9258176

SCHEMBL9258176

Cc1ccccc1C(c1ccccc1C)N1CC[N]CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 11/20 0.54
OPRD1 P41143 10/20 0.54
OPRK1 P41145 10/20 0.54
OPRL1 P41146 10/20 0.54
ESR1 P03372 1/20 0.39
CNR1 P21554 4/20 0.39
MC4R P32245 1/20 0.38
HRH2 P25021 1/20 0.37
GPR183 P32249 1/20 0.37
SLC6A3 Q01959 2/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
ADRA2A P08913 2/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL9247567 0.93 OPRM1 (0.49) OPRM1OPRD1OPRK1OPRL1ESR1
SCHEMBL9252838 0.90 OPRM1 (0.59) OPRM1OPRD1OPRK1OPRL1CNR1
SCHEMBL9257134 0.85 OPRM1 (0.54) OPRM1OPRD1OPRK1OPRL1CNR1
SCHEMBL8050827 0.79 OPRM1 (0.58) OPRM1OPRD1OPRK1OPRL1CNR1
SCHEMBL9257361 0.79 OPRM1 (0.56) OPRM1OPRD1OPRK1OPRL1MC4R
SCHEMBL9253403 0.78 OPRL1 (0.54) OPRM1OPRD1OPRK1OPRL1CNR1
SCHEMBL8963664 0.78 MEN1 (0.56) OPRM1OPRD1OPRK1OPRL1SLC6A2
SCHEMBL9253761 0.78 OPRM1 (0.54) OPRM1OPRD1OPRK1OPRL1MC4R
SCHEMBL9253066 0.73 KDM4E (0.49) OPRM1OPRD1OPRK1OPRL1CNR1
SCHEMBL9250409 0.73 OPRM1 (0.49) OPRM1OPRD1OPRK1OPRL1MC4R

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