SCHEMBL30956474

SCHEMBL30956474

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 8/20 0.56
CDK2 P24941 5/20 0.56
KCNH2 Q12809 4/20 0.56
CDK9 P50750 2/20 0.56
CDK1 P06493 1/20 0.56
CDK8 P49336 1/20 0.56
CDK7 P50613 1/20 0.56
JAK2 O60674 2/20 0.54
JAK3 P52333 2/20 0.54
PTK2 Q05397 1/20 0.54
EGFR P00533 1/20 0.47
DDB1 Q16531 1/20 0.47
CRBN Q96SW2 1/20 0.47
FLT4 P35916 4/20 0.47
KDR P35968 3/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CCNK O75909 1/20 0.46
CCNA2 P20248 1/20 0.46
CCND3 P30281 1/20 0.46

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
SCHEMBL30956399 0.90 IGF1R (0.58) IGF1RCDK2KCNH2CDK9CDK1
SCHEMBL30956553 0.87 CDK1 (0.56) IGF1RCDK2KCNH2CDK9CDK1
SCHEMBL24852515 0.87 IGF1R (0.52) IGF1RCDK2KCNH2CDK9CDK1
SCHEMBL31557672 0.87 IGF1R (0.52) IGF1RCDK2KCNH2CDK9CDK1
Lithium SCHEMBL30956422 0.87 FLT4 (0.58) IGF1RCDK2KCNH2CDK9CDK1
SCHEMBL30956411 0.85 IGF1R (0.57) IGF1RCDK2KCNH2CDK9CDK1
SCHEMBL22097740 0.83 IGF1R (0.52) IGF1RCDK2KCNH2CDK9CDK1
SCHEMBL30956537 0.83 JAK3 (0.58) IGF1RCDK2KCNH2CDK9CDK1
SCHEMBL30956585 0.81 CDK2 (0.55) IGF1RCDK2KCNH2CDK9CDK1
SCHEMBL30956562 0.81 FLT4 (0.57) IGF1RCDK2KCNH2CDK9CDK1

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