SCHEMBL30956380

SCHEMBL30956380

COC(=O)c1ncccc1-c1nc(Nc2cnn(C3CC3)c2)ncc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 3/20 0.51
CDK2 P24941 2/20 0.51
KCNH2 Q12809 2/20 0.51
CDK1 P06493 1/20 0.51
CDK8 P49336 1/20 0.51
CDK7 P50613 1/20 0.51
CDK9 P50750 1/20 0.51
JAK1 P23458 6/20 0.47
JAK3 P52333 6/20 0.47
JAK2 O60674 5/20 0.47
MAP3K7 O43318 1/20 0.46
MAPK1 P28482 1/20 0.46
MAP2K1 Q02750 1/20 0.46
FLT4 P35916 5/20 0.45
KDR P35968 5/20 0.45
FGFR2 P21802 3/20 0.45
FGFR3 P22607 3/20 0.45
FGFR1 P11362 2/20 0.45
FGFR4 P22455 2/20 0.45
TYK2 P29597 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
SCHEMBL30956547 0.90 JAK3 (0.46) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956452 0.90 CDK1 (0.51) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956585 0.88 CDK2 (0.55) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956502 0.84 NUAK1 (0.51) JAK1JAK3JAK2FLT4KDR
SCHEMBL30956618 0.84 JAK3 (0.53) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956414 0.82 IGF1R (0.45) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956431 0.82 FLT4 (0.57) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956562 0.82 FLT4 (0.57) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL24853389 0.81 IGF1R (0.52) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL28602253 0.81 IGF1R (0.49) IGF1RCDK2KCNH2CDK1CDK8

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