SCHEMBL11738668

SCHEMBL11738668

CCCC(C)(c1ccc(Cl)cc1)c1cc(O)c2c(c1)OC(C)(C)C1=C2CN(CCc2ccccc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 4/20 0.40
▸ CNR1 P21554 5/20 0.35
▸ DHCR7 Q9UBM7 1/20 0.35

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
SCHEMBL11630251 0.83 CNR2 (0.36) CNR2CNR1
Hydrochloric Acid SCHEMBL11627754 0.83 CNR1 (0.33) CNR2CNR1
SCHEMBL11717451 0.78 CNR2 (0.65) CNR2CNR1
SCHEMBL11628130 0.77 CNR2 (0.36) CNR2CNR1
SCHEMBL11741280 0.76 CNR1 (0.44) CNR2CNR1
SCHEMBL11717447 0.74 CNR2 (0.49) CNR2
SCHEMBL11815689 0.73 CNR2 (0.50) CNR2CNR1
SCHEMBL11716511 0.73 CNR2 (0.62) CNR2CNR1
SCHEMBL11717962 0.72 CNR2 (0.64) CNR2CNR1
SCHEMBL11738108 0.71 CNR2 (0.42) 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-4025630-A Anesthesia methods using benzopyrans and esters thereof as pre-anesthesia medication ABBOTT LABORATORIES (US) 1977-05-24 — — US disclosed
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