SCHEMBL11858736

SCHEMBL11858736

CCN1CCC2(CC1)OC(c1ccccc1)c1ccccc12

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 2/20 0.54
▸ KCNH2 Q12809 1/20 0.54
▸ SIGMAR1 Q99720 5/20 0.51
▸ ADRA2A P08913 1/20 0.51
▸ PRCP P42785 3/20 0.49
▸ OPRM1 P35372 1/20 0.49
▸ OPRK1 P41145 1/20 0.49
▸ SLC18A3 Q16572 1/20 0.47
▸ EBPL Q9BY08 1/20 0.47

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
SCHEMBL11684907 0.85 SIGMAR1 (0.70) OPRD1SIGMAR1ADRA2APRCPOPRM1
SCHEMBL11850101 0.85 OPRD1 (0.50) OPRD1KCNH2SIGMAR1ADRA2APRCP
SCHEMBL11682895 0.85 KCNH2 (0.57) OPRD1KCNH2SIGMAR1ADRA2APRCP
SCHEMBL11870243 0.84 OPRD1 (0.52) OPRD1KCNH2SIGMAR1ADRA2APRCP
SCHEMBL11781143 0.83 SIGMAR1 (0.51) OPRD1KCNH2SIGMAR1ADRA2APRCP
SCHEMBL11859292 0.83 SIGMAR1 (0.60) OPRD1KCNH2SIGMAR1ADRA2AOPRM1
SCHEMBL11859298 0.82 OPRD1 (0.55) OPRD1KCNH2SIGMAR1ADRA2APRCP
SCHEMBL11843820 0.82 OPRD1 (0.47) OPRD1KCNH2SIGMAR1ADRA2APRCP
SCHEMBL13366481 0.82 SIGMAR1 (0.51) OPRD1SIGMAR1ADRA2AOPRM1OPRK1
SCHEMBL11681373 0.82 OPRD1 (0.60) OPRD1KCNH2SIGMAR1ADRA2APRCP

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-3959475-A ANTIDEPRESSANT, TRANQUILIZER, ANALGESIC AMERICAN HOECHST CORPORATION (US) 1976-05-25 — — US disclosed
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