SCHEMBL30956399

SCHEMBL30956399

CC(C)(C)C(=O)N1CCC(n2cc(Nc3ncc(Cl)c(-c4ccccc4C(=O)O)n3)cn2)CC1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 10/20 0.58
CDK2 P24941 4/20 0.58
KCNH2 Q12809 4/20 0.58
CDK1 P06493 1/20 0.58
CDK8 P49336 1/20 0.58
CDK7 P50613 1/20 0.58
CDK9 P50750 1/20 0.58
FLT4 P35916 4/20 0.48
KDR P35968 3/20 0.48
JAK1 P23458 5/20 0.46
JAK3 P52333 5/20 0.46
JAK2 O60674 4/20 0.46
LRRK2 Q5S007 1/20 0.45

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
SCHEMBL30956411 0.93 IGF1R (0.57) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956474 0.90 IGF1R (0.56) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956556 0.90 IGF1R (0.48) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956553 0.89 CDK1 (0.56) IGF1RCDK2KCNH2CDK1CDK8
Lithium SCHEMBL30956422 0.88 FLT4 (0.58) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956498 0.88 IGF1R (0.52) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL24852542 0.86 IGF1R (0.54) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL31557701 0.86 IGF1R (0.54) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956417 0.85 IGF1R (0.48) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956537 0.85 JAK3 (0.58) 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