SCHEMBL11858336

SCHEMBL11858336

CP(C)(=O)CN1CCCC2(CC1)OC(c1ccccc1)c1ccccc12

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 2/20 0.47
▸ KCNH2 Q12809 1/20 0.47
▸ SIGMAR1 Q99720 6/20 0.44
▸ ADRA2A P08913 1/20 0.44
▸ PRCP P42785 4/20 0.43
▸ OPRM1 P35372 2/20 0.43
▸ OPRK1 P41145 2/20 0.43
▸ EBP Q15125 1/20 0.43
▸ SLC18A3 Q16572 1/20 0.43

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
SCHEMBL11850101 0.95 OPRD1 (0.50) OPRD1KCNH2SIGMAR1ADRA2APRCP
SCHEMBL11846973 0.92 OPRD1 (0.44) OPRD1KCNH2SIGMAR1ADRA2A
SCHEMBL11849041 0.89 OPRD1 (0.46) OPRD1KCNH2SIGMAR1ADRA2APRCP
SCHEMBL11844053 0.88 OPRD1 (0.45) OPRD1KCNH2SIGMAR1ADRA2APRCP
SCHEMBL11855274 0.87 SIGMAR1 (0.44) OPRD1KCNH2SIGMAR1ADRA2APRCP
SCHEMBL11849331 0.87 PRCP (0.51) OPRD1SIGMAR1PRCPOPRM1OPRK1
SCHEMBL11843820 0.85 OPRD1 (0.47) OPRD1KCNH2SIGMAR1ADRA2APRCP
SCHEMBL11852685 0.85 PRCP (0.47) OPRD1KCNH2SIGMAR1ADRA2APRCP
SCHEMBL11843286 0.83 OPRD1 (0.46) OPRD1KCNH2SIGMAR1ADRA2APRCP
SCHEMBL11851725 0.83 OPRD1 (0.41) 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-3996354-A 1,3-Dihydro-1'-dimethylphosphinylalkyl-3-phenylspiro(isobenzofuran)s AMERICAN HOECHST CORPORATION (US) 1976-12-07 — — US disclosed
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