SCHEMBL30956572

SCHEMBL30956572

COC(=O)c1ccccc1-c1nc(Nc2cnn(C)c2)ncc1C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 10/20 0.58
JAK2 O60674 8/20 0.58
JAK3 P52333 8/20 0.49
CDC7 O00311 2/20 0.49
DAPK3 O43293 2/20 0.49
ROCK2 O75116 2/20 0.49
PRKD3 O94806 2/20 0.49
MAP4K4 O95819 2/20 0.49
PAK4 O96013 2/20 0.49
PIM1 P11309 2/20 0.49
PRKACA P17612 2/20 0.49
CDK2 P24941 2/20 0.49
SYK P43405 2/20 0.49
CSNK1A1 P48729 2/20 0.49
CLK2 P49760 2/20 0.49
GSK3A P49840 2/20 0.49
GSK3B P49841 2/20 0.49
CDK7 P50613 2/20 0.49
CDK9 P50750 2/20 0.49
PRKX P51817 2/20 0.49

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
SCHEMBL30956586 0.89 JAK1 (0.60) JAK1JAK2JAK3CDC7DAPK3
SCHEMBL30956385 0.89 CDK2 (0.58) JAK1JAK2JAK3CDC7DAPK3
SCHEMBL30956450 0.88 JAK3 (0.51) JAK1JAK2JAK3CDK2CDK7
SCHEMBL30956393 0.88 JAK2 (0.53) JAK1JAK2JAK3TYK2STAT3
SCHEMBL30956532 0.88 JAK2 (0.46) JAK1JAK2JAK3CDC7DAPK3
SCHEMBL30956543 0.86 FLT4 (0.54) JAK1JAK2JAK3CDK2CDK7
SCHEMBL30956612 0.86 JAK3 (0.49) JAK1JAK2JAK3CDK2CDK7
SCHEMBL30956426 0.86 FLT4 (0.46) JAK1JAK2JAK3CDK2CDK7
SCHEMBL30956526 0.84 JAK3 (0.47) JAK1JAK2JAK3CDK2CDK7
SCHEMBL4559670 0.83 JAK1 (0.62) JAK1JAK2JAK3ALKTYK2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119118999-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-12-13 CN disclosed
CN-118955477-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-11-15 CN disclosed
CN-118903141-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-11-08 CN disclosed
CN-118903142-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-11-08 CN disclosed
CN-113227074-B Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-08-16 CN disclosed
CN-118388457-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-07-26 CN disclosed
CN-118290403-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-07-05 CN disclosed