SCHEMBL11850866

SCHEMBL11850866

CCCOc1ccc2c(c1)C(c1ccccc1)OC21CCN(CP(C)(C)=O)CC1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 3/20 0.40
▸ OPRD1 P41143 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ SIGMAR1 Q99720 4/20 0.39
▸ ADRA2A P08913 1/20 0.37
▸ OPRM1 P35372 1/20 0.36
▸ OPRK1 P41145 1/20 0.36
▸ EBP Q15125 1/20 0.36
▸ SLC18A3 Q16572 1/20 0.36

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
SCHEMBL11853721 0.88 PRCP (0.42) PRCPOPRD1KCNH2SIGMAR1ADRA2A
SCHEMBL11777683 0.85 PRCP (0.40) PRCPOPRD1KCNH2SIGMAR1ADRA2A
SCHEMBL11851725 0.82 OPRD1 (0.41) PRCPOPRD1KCNH2SIGMAR1ADRA2A
SCHEMBL11852054 0.81 PRCP (0.42) PRCPOPRD1KCNH2SIGMAR1ADRA2A
SCHEMBL11852685 0.78 PRCP (0.47) PRCPOPRD1KCNH2SIGMAR1ADRA2A
SCHEMBL11858336 0.78 OPRD1 (0.47) PRCPOPRD1KCNH2SIGMAR1ADRA2A
SCHEMBL11849731 0.76 OPRD1 (0.41) PRCPOPRD1KCNH2SIGMAR1ADRA2A
SCHEMBL11853169 0.76 PRCP (0.45) PRCPOPRD1KCNH2SIGMAR1OPRM1
SCHEMBL11849041 0.75 OPRD1 (0.46) PRCPOPRD1KCNH2SIGMAR1ADRA2A
SCHEMBL11844053 0.74 OPRD1 (0.45) PRCPOPRD1KCNH2SIGMAR1ADRA2A

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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