SCHEMBL20649306

SCHEMBL20649306

CN[C@H]1CCN(C(=O)Cc2csc(NC(=O)c3n[nH]c4c3C(C)(C)Cc3cnc(N)nc3-4)n2)C1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F2 P00734 4/20 0.36
F10 P00742 4/20 0.36
CSNK2A1 P68400 1/20 0.34
MAOB P27338 2/20 0.30
AOC3 Q16853 2/20 0.30

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
SCHEMBL20649080 1.00 F2 (0.36) F2F10CSNK2A1MAOBAOC3
SCHEMBL30183231 0.96 F2 (0.39) F2F10CSNK2A1MAOBAOC3
SCHEMBL20649130 0.96 F2 (0.39) F2F10CSNK2A1MAOBAOC3
SCHEMBL21875625 0.92 F2 (0.37) F2F10CSNK2A1
SCHEMBL30183504 0.92 F2 (0.37) F2F10CSNK2A1
SCHEMBL30183032 0.92 F2 (0.37) F2F10CSNK2A1
SCHEMBL21875670 0.92 F2 (0.37) F2F10CSNK2A1
SCHEMBL21875631 0.91 F2 (0.38) F2F10CSNK2A1
SCHEMBL20649083 0.90 F2 (0.40) F2F10CSNK2A1MAOBAOC3
SCHEMBL20649218 0.90 F2 (0.40) F2F10CSNK2A1MAOBAOC3

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
WO-2019011715-A1 PYRAZOLO-QUINAZOLINE DERIVATIVES AS CHOLINE KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2019-01-17 WO disclosed