SCHEMBL11797149

SCHEMBL11797149

CCCCCC(C)CCc1cc(OC(=O)CCCN2CCOCC2)c2c(c1)OC(C)(C)C1=C2CSCC1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 6/20 0.39
▸ CNR1 P21554 5/20 0.39

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
Hydrochloric Acid SCHEMBL11794134 0.93 CNR2 (0.38) CNR2CNR1
SCHEMBL11816771 0.90 CNR2 (0.40) CNR2CNR1
Hydrochloric Acid SCHEMBL11817382 0.89 CNR2 (0.40) CNR2CNR1
SCHEMBL11792856 0.89 CNR2 (0.39) CNR2CNR1
Hydrochloric Acid SCHEMBL11743926 0.88 CNR2 (0.39) CNR2CNR1
Hydrochloric Acid SCHEMBL11870307 0.88 CNR2 (0.43) CNR2CNR1
SCHEMBL11796076 0.88 CNR2 (0.37) CNR2CNR1
Hydrochloric Acid SCHEMBL11733906 0.87 CNR2 (0.36) CNR2CNR1
SCHEMBL11797143 0.87 CNR1 (0.33) CNR2CNR1
SCHEMBL11810951 0.86 CNR2 (0.40) 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-3972880-A TRANQUILIZER SHARPS ASSOCIATES (US) 1976-08-03 — — US claimed
Send feedback