SCHEMBL24716006

SCHEMBL24716006

CSc1ccccc1Nc1nc(Cl)ncc1C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ULK1 O75385 3/20 0.48
PTK2 Q05397 3/20 0.44
MAPK3 P27361 3/20 0.42
CDC7 O00311 1/20 0.41
ROCK2 O75116 1/20 0.41
MAP4K4 O95819 1/20 0.41
PIM1 P11309 1/20 0.41
PRKACA P17612 1/20 0.41
CDK7 P50613 1/20 0.41
CDK9 P50750 1/20 0.41
HIPK2 Q9H2X6 1/20 0.41
IRAK4 Q9NWZ3 1/20 0.41
CDK1 P06493 1/20 0.41
CDK4 P11802 1/20 0.41
CDK2 P24941 1/20 0.41
STK10 O94804 1/20 0.41
SLK Q9H2G2 1/20 0.41
TRPV1 Q8NER1 1/20 0.40
KDR P35968 2/20 0.39
JAK2 O60674 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
SCHEMBL24715923 0.88 ULK1 (0.44) ULK1PTK2MAPK3CDC7ROCK2
SCHEMBL29575332 0.85 ULK1 (0.66) ULK1PTK2MAPK3CDC7ROCK2
SCHEMBL17547451 0.85 ULK1 (0.66) ULK1PTK2MAPK3CDC7ROCK2
SCHEMBL25692091 0.83 ULK1 (0.44) ULK1PTK2MAPK3CDC7ROCK2
SCHEMBL30223473 0.82 CCNA2 (0.44) ULK1PTK2CDK9CDK2STK10
SCHEMBL24073506 0.82 CCNA2 (0.44) ULK1PTK2CDK9CDK2STK10
SCHEMBL28295859 0.81 ULK1 (0.47) ULK1PTK2MAPK3CDC7ROCK2
SCHEMBL4025891 0.80 IGF1R (0.52) PTK2IGF1RLRRK2
SCHEMBL30833716 0.80 IGF1R (0.52) PTK2IGF1RLRRK2
SCHEMBL25278838 0.79 ULK1 (0.45) ULK1PTK2MAPK3CDC7ROCK2

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-2022214008-A1 HIGHLY ACTIVE HPK1 KINASE INHIBITOR 杭州阿诺生物医药科技有限公司 2022-10-13 WO disclosed