SCHEMBL11736633

SCHEMBL11736633

CCCCC(c1cc(F)cc(F)c1)c1cc(O)c2c(c1)OC(C)(C)C1=C2CCC1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 5/20 0.43
▸ CNR1 P21554 4/20 0.43
▸ MEN1 O00255 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL11739301 0.81 CNR2 (0.48) CNR2CNR1MEN1GAAKMT2A
SCHEMBL11734041 0.80 CNR2 (0.46) CNR2CNR1MEN1GAAKMT2A
SCHEMBL31546201 0.80 CNR2 (0.46) CNR2CNR1MEN1GAAKMT2A
SCHEMBL11742241 0.78 CNR2 (0.46) CNR2CNR1MEN1GAAKMT2A
SCHEMBL11734536 0.77 CNR2 (0.37) CNR2CNR1
SCHEMBL11736638 0.76 CNR2 (0.58) CNR2CNR1MEN1GAAKMT2A
SCHEMBL31545877 0.76 — —
SCHEMBL11738579 0.76 — —
SCHEMBL11816067 0.74 CNR2 (0.71) CNR2CNR1
SCHEMBL11739308 0.73 CNR2 (0.72) 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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