SCHEMBL11715904

SCHEMBL11715904

CCCCCCc1cc(OC(=O)CN2CCCCCC2)c2c(c1)OC(C)(C)C1=C2CN(Cc2ccccc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 4/20 0.45
▸ CNR1 P21554 3/20 0.45

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
SCHEMBL11631332 0.92 — —
Hydrochloric Acid SCHEMBL11720807 0.85 CNR2 (0.43) CNR2CNR1
Hydrochloric Acid SCHEMBL11714544 0.84 CNR2 (0.43) CNR2CNR1
SCHEMBL11717962 0.82 CNR2 (0.64) CNR2CNR1
SCHEMBL11716511 0.81 CNR2 (0.62) CNR2CNR1
SCHEMBL11865126 0.79 CNR2 (0.43) CNR2CNR1
SCHEMBL11869317 0.79 CNR2 (0.43) CNR2CNR1
Hydrochloric Acid SCHEMBL11713834 0.78 CNR2 (0.42) CNR2CNR1
Hydrochloric Acid SCHEMBL11719879 0.78 CNR2 (0.38) CNR2CNR1
Cadaverine Tartrate SCHEMBL11723809 0.78 CNR2 (0.41) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4042694-A ANALGESICS SHARPS ASSOCIATES (US) 1977-08-16 — — US disclosed
US-4025630-A Anesthesia methods using benzopyrans and esters thereof as pre-anesthesia medication ABBOTT LABORATORIES (US) 1977-05-24 — — US disclosed
US-3991194-A Heterocyclic esters of benzopyranopyridines SHARPS ASSOCIATES (US) 1976-11-09 — — US disclosed
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