SCHEMBL11224032

SCHEMBL11224032

CN1CCC(Oc2ccc(C(F)(F)F)cc2)(c2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 4/20 0.50
▸ TACR1 P25103 9/20 0.47
▸ SLC6A4 P31645 9/20 0.47
▸ OPRM1 P35372 3/20 0.46
▸ OPRL1 P41146 2/20 0.46
▸ KCNH2 Q12809 6/20 0.43
▸ CCR6 P51684 1/20 0.43
▸ HSD11B1 P28845 1/20 0.41
▸ OPRD1 P41143 1/20 0.40
▸ OPRK1 P41145 1/20 0.40
▸ PDE2A O00408 1/20 0.40
▸ DRD4 P21917 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
SCHEMBL11155552 0.85 OPRM1 (0.49) SLC6A4OPRM1OPRL1KCNH2OPRD1
Hydrochloric Acid SCHEMBL11153301 0.84 OPRM1 (0.47) SLC6A4OPRM1OPRL1KCNH2OPRD1
SCHEMBL10512960 0.83 TACR1 (0.52) DRD2TACR1OPRM1OPRL1
SCHEMBL11737881 0.82 POLB (0.55) DRD2TACR1SLC6A4OPRM1OPRL1
SCHEMBL11155388 0.81 OPRM1 (0.46) SLC6A4OPRM1OPRL1KCNH2OPRD1
SCHEMBL10514541 0.81 THRB (0.41) DRD2TACR1OPRM1OPRL1HSD11B1
SCHEMBL10515742 0.80 OPRM1 (0.44) DRD2TACR1OPRM1OPRL1KCNH2
SCHEMBL10513647 0.80 TRPM8 (0.43) DRD2TACR1OPRM1OPRL1
SCHEMBL7342703 0.80 TACR1 (0.52) DRD2TACR1SLC6A4OPRM1OPRL1
SCHEMBL11740042 0.79 CYP3A4 (0.48) —

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-4325953-A 4-Aryl-4-aryloxypiperidines JOHN WYETH AND BROTHER LIMITED (GB) 1982-04-20 — — US claimed
US-4325953-A 4-Aryl-4-aryloxypiperidines JOHN WYETH AND BROTHER LIMITED (GB) 1982-04-20 — — US disclosed
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