SCHEMBL29150545

SCHEMBL29150545

O=C1NCc2c(-c3ccncc3)ccc(Br)c21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 3/20 0.42
CSNK1A1 P48729 2/20 0.42
CDK5 Q00535 2/20 0.42
ROCK1 Q13464 2/20 0.42
DYRK1A Q13627 2/20 0.42
LRRK2 Q5S007 2/20 0.42
DYRK1B Q9Y463 2/20 0.42
PIM1 P11309 1/20 0.42
PARP10 Q53GL7 1/20 0.42
PARP11 Q9NR21 1/20 0.42
CDC7 O00311 6/20 0.41
MAP3K9 P80192 2/20 0.37
MAP3K11 Q16584 2/20 0.37
MAPT P10636 1/20 0.37
BRAF P15056 1/20 0.35
KDR P35968 4/20 0.35
PKN1 Q16512 3/20 0.34
PKN2 Q16513 3/20 0.34
CLK2 P49760 2/20 0.34
PDE3B Q13370 2/20 0.34

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
SCHEMBL30701043 0.81 KDR (0.50) PARP10PARP11CDC7MAP3K9MAP3K11
SCHEMBL30775227 0.81 PDE3B (0.45) CLK4ROCK1PIM1PARP10PARP11
SCHEMBL18170546 0.81 KDR (0.50) PARP10PARP11CDC7MAP3K9MAP3K11
SCHEMBL30775326 0.78 CSF1R (0.47) PARP10PARP11KDR
SCHEMBL30775281 0.78 PARP10 (0.43) PARP10PARP11CDC7MAP3K9MAP3K11
SCHEMBL18170438 0.77 CDC7 (0.40) ROCK1PARP10PARP11CDC7MAP3K9
SCHEMBL30775395 0.77 PARP10 (0.39) PARP10PARP11CDC7MAP3K9MAP3K11
SCHEMBL29845432 0.73 CLK4 (0.57) CLK4CSNK1A1CDK5ROCK1DYRK1A
SCHEMBL23089702 0.71 PIM1 (0.44) CLK4CSNK1A1CDK5ROCK1DYRK1A
SCHEMBL3042262 0.71 PIM1 (0.44) CLK4CSNK1A1CDK5ROCK1DYRK1A

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
CN-117295737-A HPK1 antagonists and uses thereof 林伯士萨顿公司 2023-12-26 CN disclosed