SCHEMBL11740344

SCHEMBL11740344

CCCCCC(C)C(C)c1cc(OC(C)=O)c2c(c1)OC(C)(C)C1=C2C(C)CCC1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 7/20 0.50
▸ CNR1 P21554 6/20 0.50
▸ ESR1 P03372 1/20 0.31

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
SCHEMBL11774734 0.88 CNR1 (0.44) CNR2CNR1
Hydrochloric Acid SCHEMBL11812852 0.86 CNR1 (0.38) CNR2CNR1
SCHEMBL11740274 0.86 CNR2 (0.44) CNR2CNR1ESR1
SCHEMBL11774905 0.85 CNR2 (0.45) CNR2CNR1
SCHEMBL11738900 0.85 CNR2 (0.45) CNR2CNR1
SCHEMBL11811378 0.85 CNR1 (0.37) CNR2CNR1
SCHEMBL11740560 0.85 CNR2 (0.43) CNR2CNR1
SCHEMBL31545894 0.85 CNR2 (0.43) CNR2CNR1
SCHEMBL11814818 0.85 CNR1 (0.37) CNR2CNR1
SCHEMBL11739647 0.83 CNR2 (0.51) CNR2CNR1

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-4051152-A TRANQUILIZERS, ANALGESICS SHARPS ASSOCIATES (US) 1977-09-27 — — US disclosed
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