SCHEMBL8646167

SCHEMBL8646167

COc1ccc(/C=C\c2ccc(C3(O)CN4CCC3CC4)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.58
CHRM1 P11229 3/20 0.50
CHRM2 P08172 2/20 0.50
CHRM4 P08173 2/20 0.50
CHRM5 P08912 2/20 0.50
CHRM3 P20309 2/20 0.50
CHRNA7 P36544 1/20 0.44

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
SCHEMBL8646173 1.00 KMT2A (0.58) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL8647531 1.00 KMT2A (0.58) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL9492525 0.92 KMT2A (0.68) KMT2ACHRM1CHRM2CHRM4CHRM5
Oxalic Acid SCHEMBL9494462 0.85 KMT2A (0.59) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL8647576 0.83 KMT2A (0.60) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL8647579 0.83 KMT2A (0.60) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL8649491 0.83 KMT2A (0.60) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL2421988 0.83 KMT2A (0.56) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL8640300 0.78 KMT2A (0.56) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL8640304 0.78 KMT2A (0.56) KMT2ACHRM1CHRM2CHRM4CHRM5

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0596057-B1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LTD (GB) 1998-09-09 EP claimed
EP-0596057-A1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LIMITED (GB) 1994-05-11 EP claimed
WO-1993021183-A1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LIMITED (GB) 1993-10-28 WO claimed
EP-0596057-B1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LTD (GB) 1998-09-09 EP disclosed
EP-0596057-A1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LIMITED (GB) 1994-05-11 EP disclosed
WO-1993021183-A1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LIMITED (GB) 1993-10-28 WO disclosed