SCHEMBL11837320

SCHEMBL11837320

CCCCCC(C)C(C)c1cc(OC(=O)CC)c2c(c1)OC1=C(CCC(C)C1)C2C

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 3/20 0.33
▸ CNR1 P21554 2/20 0.33

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
SCHEMBL11831333 0.94 CNR1 (0.33) CNR2CNR1
SCHEMBL11841396 0.94 CNR1 (0.33) CNR2CNR1
SCHEMBL11830187 0.93 ACE2 (0.33) CNR2CNR1
SCHEMBL11831341 0.88 CNR1 (0.33) CNR2CNR1
SCHEMBL11826974 0.85 CNR2 (0.40) CNR2CNR1
SCHEMBL11834421 0.84 CNR2 (0.39) CNR2CNR1
SCHEMBL11833016 0.84 CNR2 (0.39) CNR2CNR1
SCHEMBL11829169 0.84 CNR2 (0.39) CNR2CNR1
SCHEMBL11838617 0.82 ACE2 (0.33) CNR2CNR1
SCHEMBL11826906 0.78 CNR2 (0.39) 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-3931232-A 3-Alkyl xanthene compounds SMITHKLINE CORPORATION (US) 1976-01-06 — — US disclosed
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