SCHEMBL20923693

SCHEMBL20923693

N#Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3ccncc3)c(C#N)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 2/20 0.39
CYP19A1 P11511 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
PTGER4 P35408 1/20 0.36
GSK3B P49841 2/20 0.35
PRKACA P17612 1/20 0.35
CDK8 P49336 1/20 0.35
CLK2 P49760 1/20 0.35
GSK3A P49840 1/20 0.35
CDK9 P50750 1/20 0.35
CDK5 Q00535 1/20 0.35
PRKCQ Q04759 1/20 0.35
ROCK1 Q13464 1/20 0.35
DYRK1A Q13627 1/20 0.35
LRRK2 Q5S007 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
DYRK1B Q9Y463 1/20 0.35
PGR P06401 1/20 0.35
GCGR P47871 1/20 0.35

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
SCHEMBL20924084 0.94 CYP19A1 (0.40) FLT3CYP19A1CYP11B1CYP11B2PTGER4
SCHEMBL20923110 0.94 PIK3CA (0.41) CYP19A1GSK3BPRKACACDK8CLK2
SCHEMBL20923180 0.93 CYP19A1 (0.35) FLT3CYP19A1CYP11B1CYP11B2GSK3B
SCHEMBL20923704 0.92 CYP19A1 (0.42) FLT3CYP19A1CYP11B1CYP11B2PTGER4
SCHEMBL20923661 0.92 FLT3 (0.39) FLT3CYP19A1CYP11B1CYP11B2PTGER4
SCHEMBL20923617 0.90 PIK3CA (0.43) CYP19A1CYP11B1CYP11B2GSK3BPRKACA
SCHEMBL20923374 0.90 LMNA (0.39) CYP19A1CYP11B1CYP11B2MAPK14ALDH1A1
SCHEMBL20923296 0.90 LMNA (0.39) CYP19A1CYP11B1CYP11B2MAPK14ALDH1A1
SCHEMBL20923694 0.89 FLT3 (0.41) FLT3CYP19A1CYP11B1CYP11B2GSK3B
SCHEMBL20924076 0.88 STS (0.40) FLT3CYP19A1CYP11B1CYP11B2GSK3B

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
EP-3266772-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-04-24 EP disclosed