SCHEMBL29897364

SCHEMBL29897364

Cc1cccc(F)c1-c1cc(NC2CCN(C(=O)OC(C)(C)C)CC2)c2ccncc2c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 1/20 0.50
DYRK1A Q13627 1/20 0.46
CCNA2 P20248 1/20 0.45
CDK2 P24941 1/20 0.45
BTK Q06187 1/20 0.43
GPR119 Q8TDV5 5/20 0.42
SYK P43405 1/20 0.42
PIK3CA P42336 1/20 0.42
BRD4 O60885 1/20 0.41
PIM1 P11309 1/20 0.41
PIM2 Q9P1W9 1/20 0.41
CNR1 P21554 1/20 0.41
DNMT3A Q9Y6K1 1/20 0.41
ALDH1A1 P00352 1/20 0.40
ROCK2 O75116 1/20 0.40
CCR2 P41597 1/20 0.40
ROCK1 Q13464 1/20 0.40
CCNT1 O60563 1/20 0.40
NSD2 O96028 1/20 0.40

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
SCHEMBL23301036 1.00 PRKCZ (0.50) PRKCZDYRK1ACCNA2CDK2BTK
SCHEMBL25044342 0.92 PRKCZ (0.49) PRKCZDYRK1ABTKGPR119PIM1
SCHEMBL23328348 0.90 DYRK1A (0.46) PRKCZDYRK1ACCNA2CDK2BTK
SCHEMBL23301073 0.88 PRKCZ (0.54) PRKCZROCK2CCR2ROCK1
SCHEMBL29897394 0.88 BTK (0.44) CCNA2CDK2BTKGPR119SYK
SCHEMBL23301537 0.88 BTK (0.44) CCNA2CDK2BTKGPR119SYK
SCHEMBL29897354 0.87 ABL1 (0.46) CCNA2CDK2BTKGPR119SYK
SCHEMBL23301815 0.87 ABL1 (0.46) CCNA2CDK2BTKGPR119SYK
SCHEMBL23301759 0.86 GPR119 (0.49) DYRK1ACCNA2CDK2BTKGPR119
SCHEMBL29897408 0.86 GPR119 (0.49) DYRK1ACCNA2CDK2BTKGPR119

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-4051664-A1 ISOQUINOLINE DERIVATIVES AS SIK2 INHIBITORS Cancer Research Technology Limited (GB) 2022-09-07 EP disclosed