SCHEMBL30956547

SCHEMBL30956547

COC(=O)c1ncccc1-c1nc(Nc2cnn(C3CC3)c2)ncc1C

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 7/20 0.46
JAK2 O60674 6/20 0.46
JAK1 P23458 5/20 0.46
TYK2 P29597 2/20 0.46
MAP4K1 Q92918 2/20 0.45
NUAK1 O60285 1/20 0.43
IGF1R P08069 4/20 0.43
CDK1 P06493 1/20 0.43
CDK2 P24941 1/20 0.43
CDK8 P49336 1/20 0.43
CDK7 P50613 1/20 0.43
CDK9 P50750 1/20 0.43
KCNH2 Q12809 1/20 0.43
FGFR2 P21802 3/20 0.42
FGFR3 P22607 3/20 0.42
FGFR1 P11362 2/20 0.42
FGFR4 P22455 2/20 0.42
FLT4 P35916 1/20 0.42
LRRK2 Q5S007 1/20 0.41

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
SCHEMBL30956502 0.94 NUAK1 (0.51) JAK3JAK2JAK1TYK2NUAK1
SCHEMBL30956414 0.92 IGF1R (0.45) JAK3JAK2JAK1TYK2IGF1R
SCHEMBL30956609 0.91 JAK1 (0.47) JAK3JAK2JAK1TYK2MAP4K1
SCHEMBL30956380 0.90 IGF1R (0.51) JAK3JAK2JAK1TYK2NUAK1
SCHEMBL30956448 0.89 JAK3 (0.53) JAK3JAK2IGF1RCDK1CDK2
SCHEMBL30956450 0.88 JAK3 (0.51) JAK3JAK2JAK1TYK2MAP4K1
SCHEMBL30956526 0.84 JAK3 (0.47) JAK3JAK2JAK1TYK2MAP4K1
SCHEMBL30956552 0.84 JAK3 (0.49) JAK3JAK2JAK1TYK2LRRK2
SCHEMBL30956612 0.84 JAK3 (0.49) JAK3JAK2JAK1TYK2NUAK1
SCHEMBL30956567 0.82 JAK3 (0.54) JAK3JAK2JAK1TYK2MAP4K1

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