SCHEMBL22971571

SCHEMBL22971571

COc1ccc(C)c2c1O[C@H]1CC=CC3C(C)N(C)CCC231

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 16/20 0.66
OPRD1 P41143 11/20 0.66
OPRK1 P41145 10/20 0.66
MRGPRX2 Q96LB1 2/20 0.47
ADRB1 P08588 1/20 0.47
PDE4D Q08499 1/20 0.47
PDE3A Q14432 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
SCHEMBL14154485 0.84 OPRM1 (0.55) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL18867882 0.83 OPRM1 (0.67) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL14463456 0.83 OPRM1 (0.67) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL13656808 0.83 OPRM1 (0.67) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL13668804 0.83 OPRM1 (0.67) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL18867763 0.80 OPRM1 (0.68) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL30199760 0.79 OPRM1 (1.00) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL21008992 0.79 OPRM1 (1.00) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL18569385 0.79 OPRM1 (1.00) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL14501896 0.78 OPRM1 (0.55) OPRM1OPRD1OPRK1MRGPRX2ADRB1

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
WO-2021024041-A1 CONTROLLED RELEASE DRUG DIMERS RIPPLE THERAPEUTICS CORPORATION (CA) 2021-02-11 WO disclosed