SCHEMBL30956447

SCHEMBL30956447

COC(=O)c1ccccc1-c1nc(Nc2cnn(C3CCN(C(=O)C4(F)CC4)CC3)c2)ncc1C

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 11/20 0.46
CDK1 P06493 1/20 0.46
CDK2 P24941 1/20 0.46
CDK8 P49336 1/20 0.46
CDK7 P50613 1/20 0.46
CDK9 P50750 1/20 0.46
KCNH2 Q12809 1/20 0.46
FLT4 P35916 4/20 0.46
JAK1 P23458 5/20 0.43
JAK3 P52333 5/20 0.43
JAK2 O60674 4/20 0.42
TYK2 P29597 3/20 0.42
KDR P35968 1/20 0.41

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
SCHEMBL30956451 0.92 IGF1R (0.47) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956569 0.92 IGF1R (0.47) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956545 0.89 IGF1R (0.46) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956432 0.89 IGF1R (0.46) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956408 0.88 IGF1R (0.49) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956450 0.88 JAK3 (0.51) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956543 0.87 FLT4 (0.54) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL24853238 0.87 IGF1R (0.46) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956561 0.87 IGF1R (0.48) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956469 0.85 JAK3 (0.42) IGF1RCDK1CDK2CDK8CDK7

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