SCHEMBL8775337

SCHEMBL8775337

Cc1ccc(-c2ccc(C3(O)CN4CCC3CC4)cc2)nc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.67
CHRM1 P11229 3/20 0.49
CHRM2 P08172 2/20 0.49
CHRM4 P08173 2/20 0.49
CHRM5 P08912 2/20 0.49
CHRM3 P20309 2/20 0.49
CHRNA7 P36544 1/20 0.43

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
SCHEMBL4457516 0.82 CHRM1 (0.58) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL8775346 0.81 KMT2A (0.60) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL8775355 0.80 CHRM1 (0.63) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL8775603 0.79 CHRM1 (0.60) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL9265598 0.78 KMT2A (0.45) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL7761959 0.77 KMT2A (0.58) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL9458720 0.75 KMT2A (0.62) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL8775496 0.75 KMT2A (0.58) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL8775364 0.74 KMT2A (0.61) KMT2ACHRM1CHRM2CHRM4CHRM5
SCHEMBL8775378 0.74 KMT2A (0.58) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0598093-B1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHETASE INHIBITORS ZENECA LTD (GB) 1997-11-19 EP claimed
EP-0598093-A1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHETASE INHIBITORS ZENECA LIMITED (GB) 1994-05-25 EP claimed
WO-1993024486-A1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHETASE INHIBITORS ZENECA LIMITED (GB) 1993-12-09 WO claimed
EP-0598093-B1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHETASE INHIBITORS ZENECA LTD (GB) 1997-11-19 EP disclosed
US-5554613-A QUINUCLIDINE DERIVATIVES, QUALENE SYNTHASE INHIBITORS, TREATMENT OF HYPERCHOLESTEROLEMIA, ATHEROSCLEROSIS AND FUNGUS INFECTIONS ZENECA LIMITED (GB) 1996-09-10 US disclosed