SCHEMBL20783136

SCHEMBL20783136

C=C1C=C(c2ccnc3[nH]ccc23)C=C(c2ccccc2C(F)(F)F)N1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKACA P17612 3/20 0.43
JAK2 O60674 2/20 0.43
JAK3 P52333 2/20 0.43
PRKCQ Q04759 2/20 0.43
ROCK1 Q13464 2/20 0.43
RET P07949 2/20 0.43
AURKB Q96GD4 2/20 0.43
MAP4K4 O95819 2/20 0.43
IKBKB O14920 1/20 0.43
CHUK O15111 1/20 0.43
DAPK3 O43293 1/20 0.43
PRKD3 O94806 1/20 0.43
PAK4 O96013 1/20 0.43
CSF1R P07333 1/20 0.43
IGF1R P08069 1/20 0.43
FGFR1 P11362 1/20 0.43
FLT1 P17948 1/20 0.43
LTK P29376 1/20 0.43
GRK5 P34947 1/20 0.43
KDR P35968 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
SCHEMBL20783033 0.84 TRPA1 (0.40) JAK2PRKCQROCK1NUDT1ROCK2
SCHEMBL24445800 0.81 JAK2 (0.40) PRKACAJAK2JAK3PRKCQROCK1
SCHEMBL20783145 0.80 NUDT1 (0.43) NUDT1
SCHEMBL10124925 0.80 IGF1R (0.58) PRKACAJAK2JAK3PRKCQROCK1
SCHEMBL20783030 0.79 CDK9 (0.45) CDK7CDK9GSK3BCDK1CDK2
SCHEMBL24445629 0.76 PIK3C3 (0.48) PRKACAJAK2JAK3PRKCQROCK1
SCHEMBL20782478 0.72 PIK3C3 (0.45) MAPK8GSK3BEGFR
SCHEMBL20782273 0.69 PIK3C3 (0.47) CLK4AAK1CDC7
SCHEMBL24240602 0.69 PIK3C3 (0.46) JAK2AAK1
SCHEMBL20776165 0.68 PIK3C3 (0.44)

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-2019038384-A1 AZAINDOLYLPYRIDONE AND DIAZAINDOLYLPYRIDONE COMPOUNDS SPRINT BIOSCIENCE AB (SE) 2019-02-28 WO disclosed