SCHEMBL30956598

SCHEMBL30956598

Cc1cnc(Nc2cnn(C3CCN(C(=O)C4CC4)CC3)c2)nc1-c1ccccc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 13/20 0.50
CDK1 P06493 1/20 0.50
CDK2 P24941 1/20 0.50
CDK8 P49336 1/20 0.50
CDK7 P50613 1/20 0.50
CDK9 P50750 1/20 0.50
KCNH2 Q12809 1/20 0.50
JAK3 P52333 5/20 0.47
JAK1 P23458 4/20 0.47
JAK2 O60674 3/20 0.47
TYK2 P29597 2/20 0.47
FLT4 P35916 1/20 0.46
NUAK1 O60285 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
SCHEMBL30956518 0.92 JAK1 (0.46) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956408 0.92 IGF1R (0.49) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956567 0.91 JAK3 (0.54) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956615 0.90 FLT4 (0.55) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL28605528 0.90 IGF1R (0.48) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956428 0.90 IGF1R (0.49) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956406 0.89 IGF1R (0.47) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956417 0.89 IGF1R (0.48) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956386 0.89 IGF1R (0.48) IGF1RCDK1CDK2CDK8CDK7
SCHEMBL30956622 0.89 IGF1R (0.46) 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