SCHEMBL30956498

SCHEMBL30956498

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

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 12/20 0.52
CDK2 P24941 5/20 0.52
KCNH2 Q12809 5/20 0.52
CDK1 P06493 1/20 0.52
CDK8 P49336 1/20 0.52
CDK7 P50613 1/20 0.52
CDK9 P50750 1/20 0.52
JAK2 O60674 1/20 0.47
JAK1 P23458 1/20 0.47
JAK3 P52333 1/20 0.47
FLT4 P35916 5/20 0.45
KDR P35968 4/20 0.45
LRRK2 Q5S007 2/20 0.44

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
SCHEMBL30956381 0.90 FLT4 (0.55) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956399 0.88 IGF1R (0.58) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL24853215 0.88 JAK2 (0.61) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL29941772 0.88 JAK2 (0.61) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956411 0.87 IGF1R (0.57) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956444 0.84 JAK3 (0.49) IGF1RCDK2KCNH2CDK1CDK8
SCHEMBL30956581 0.83 JAK2 (0.53) CDK2CDK7CDK9JAK2JAK1
SCHEMBL22089941 0.81 JAK2 (0.61) IGF1RJAK2JAK1JAK3
SCHEMBL29941565 0.81 JAK2 (0.61) IGF1RJAK2JAK1JAK3
SCHEMBL28618377 0.81 JAK3 (0.45) 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