SCHEMBL22562516

SCHEMBL22562516

N#Cc1ccc2c3ccccc3n(-c3cc(C#N)c(-c4cccc(-c5ccccc5)n4)cc3-n3c4ccccc4c4ccc(C#N)cc43)c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 3/20 0.39
JAK2 O60674 1/20 0.39
PRKD3 O94806 1/20 0.39
ABL1 P00519 1/20 0.39
EGFR P00533 1/20 0.39
ERBB2 P04626 1/20 0.39
LCK P06239 1/20 0.39
CDK1 P06493 1/20 0.39
CSF1R P07333 1/20 0.39
LYN P07948 1/20 0.39
RET P07949 1/20 0.39
KIT P10721 1/20 0.39
FGFR1 P11362 1/20 0.39
FER P16591 1/20 0.39
FLT1 P17948 1/20 0.39
FGFR3 P22607 1/20 0.39
KDR P35968 1/20 0.39
FLT3 P36888 1/20 0.39
FRK P42685 1/20 0.39
SYK P43405 1/20 0.39

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
SCHEMBL22562517 0.97 CSNK2A1 (0.40) CLK4JAK2PRKD3ABL1EGFR
SCHEMBL22562341 0.94 CLK4 (0.39) CLK4JAK2PRKD3ABL1EGFR
SCHEMBL22562597 0.93 MYC (0.39) CLK4JAK2PRKD3ABL1EGFR
SCHEMBL22562351 0.91 CLK4 (0.40) CLK4JAK2PRKD3ABL1EGFR
SCHEMBL22562514 0.90 CSNK2A1 (0.38) CLK4JAK2PRKD3ABL1EGFR
SCHEMBL22562205 0.90 ALDH1A3 (0.38) CLK4ABCG2ALDH1A3ABCB1ADORA2A
SCHEMBL22562223 0.89 ALDH1A3 (0.37) CLK4JAK2PRKD3ABL1EGFR
SCHEMBL22562252 0.89 MAPK1 (0.38) CSNK2A1ADORA2AMEN1KMT2ARAB9A
SCHEMBL22562603 0.89 ALDH1A3 (0.46) CLK4IRAK4ALDH1A3ADORA2AMEN1
SCHEMBL22562605 0.89 MYC (0.41) CLK4JAK2PRKD3ABL1EGFR

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-3418278-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-10-21 EP disclosed