SCHEMBL11684960

SCHEMBL11684960

ON1CCC2(CC1)OC(c1ccccc1)c1ccccc12

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 2/20 0.57
▸ KCNH2 Q12809 1/20 0.57
▸ SIGMAR1 Q99720 5/20 0.48
▸ PRCP P42785 3/20 0.44
▸ OPRM1 P35372 1/20 0.43
▸ OPRK1 P41145 1/20 0.43
▸ ADRA2A P08913 1/20 0.42
▸ SLC18A3 Q16572 1/20 0.41
▸ EBPL Q9BY08 1/20 0.41

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
SCHEMBL11687660 0.89 PRCP (0.49) OPRD1KCNH2SIGMAR1PRCPOPRM1
SCHEMBL11682595 0.86 OPRD1 (0.45) OPRD1KCNH2SIGMAR1PRCPADRA2A
SCHEMBL11681373 0.85 OPRD1 (0.60) OPRD1KCNH2SIGMAR1PRCPOPRM1
SCHEMBL11682895 0.85 KCNH2 (0.57) OPRD1KCNH2SIGMAR1PRCPOPRM1
SCHEMBL11862874 0.82 OPRD1 (0.52) OPRD1KCNH2SIGMAR1PRCPADRA2A
SCHEMBL11884181 0.82 OPRD1 (0.57) OPRD1KCNH2SIGMAR1PRCPOPRM1
SCHEMBL11681814 0.82 OPRD1 (0.54) OPRD1KCNH2SIGMAR1PRCPOPRM1
SCHEMBL11858736 0.82 OPRD1 (0.54) OPRD1KCNH2SIGMAR1PRCPOPRM1
SCHEMBL11680301 0.81 OPRD1 (0.43) OPRD1KCNH2SIGMAR1PRCPADRA2A
SCHEMBL11880458 0.81 OPRD1 (0.53) OPRD1KCNH2SIGMAR1PRCPOPRM1

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-4024263-A ANALGESIC, ANTICONVULSANT, ANTIDEPRESSANT AMERICAN HOECHST CORPORATION (US) 1977-05-17 — — US claimed
US-4024263-A ANALGESIC, ANTICONVULSANT, ANTIDEPRESSANT AMERICAN HOECHST CORPORATION (US) 1977-05-17 — — US disclosed
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