SCHEMBL8619686

SCHEMBL8619686

OC1(c2ccc(Oc3ccc4ccccc4n3)cc2)CN2CCC1CC2

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 4/20 0.48
CHRM4 P08173 4/20 0.48
CHRM5 P08912 4/20 0.48
CHRM1 P11229 4/20 0.48
CHRM3 P20309 4/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL8623904 0.84 CHRM2 (0.46) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8621343 0.80 CHRM1 (0.59) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL7761926 0.80 CHRM2 (0.53) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4689035 0.76 KMT2A (0.57) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9273210 0.73 KMT2A (0.49) CHRM2CHRM4CHRM5CHRM1CHRM3
Hydrochloric Acid SCHEMBL9268537 0.70 KMT2A (0.51) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL5065834 0.70 KMT2A (0.65) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8647144 0.70 KMT2A (0.53) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL2421988 0.69 KMT2A (0.56) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL7759994 0.69 CHRM2 (0.68) CHRM2CHRM4CHRM5CHRM1CHRM3

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
EP-0674636-B1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LTD (GB) 1998-05-20 EP disclosed
EP-0674636-A1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LIMITED (GB) 1995-10-04 EP disclosed
WO-1994014804-A1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LIMITED (GB) 1994-07-07 WO disclosed