SCHEMBL30956570

SCHEMBL30956570

Cc1cnc(Nc2cnn(C3CC(C)NC(C)C3)c2)nc1-c1ccccc1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 10/20 0.45
JAK2 O60674 9/20 0.45
JAK3 P52333 9/20 0.45
TYK2 P29597 2/20 0.45
NUAK1 O60285 2/20 0.42
IGF1R P08069 4/20 0.41
CDK1 P06493 1/20 0.41
CDK2 P24941 1/20 0.41
CDK8 P49336 1/20 0.41
CDK7 P50613 1/20 0.41
CDK9 P50750 1/20 0.41
KCNH2 Q12809 1/20 0.41
FLT4 P35916 1/20 0.40
AURKA O14965 1/20 0.39
AURKB Q96GD4 1/20 0.39
AURKC Q9UQB9 1/20 0.39
MAP4K1 Q92918 1/20 0.39

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
SCHEMBL30956479 1.00 JAK1 (0.45) JAK1JAK2JAK3TYK2NUAK1
SCHEMBL30956540 0.89 JAK1 (0.47) JAK1JAK2JAK3TYK2NUAK1
SCHEMBL30956567 0.89 JAK3 (0.54) JAK1JAK2JAK3TYK2NUAK1
SCHEMBL30956557 0.88 FLT4 (0.47) JAK1JAK2JAK3TYK2NUAK1
SCHEMBL30956437 0.86 NUAK1 (0.57) JAK1JAK2JAK3TYK2NUAK1
SCHEMBL30956513 0.86 JAK3 (0.51) JAK1JAK2JAK3TYK2NUAK1
SCHEMBL30956439 0.85 JAK3 (0.51) JAK1JAK2JAK3TYK2NUAK1
SCHEMBL24852539 0.85 JAK2 (0.42) JAK1JAK2JAK3TYK2IGF1R
SCHEMBL22097988 0.85 JAK2 (0.42) JAK1JAK2JAK3TYK2IGF1R
SCHEMBL22097938 0.85 JAK2 (0.42) JAK1JAK2JAK3TYK2IGF1R

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