SCHEMBL30956482

SCHEMBL30956482

Cc1cnc(Nc2cnn(CCC#N)c2)nc1-c1ccccc1C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 18/20 0.66
JAK3 P52333 18/20 0.66
JAK1 P23458 17/20 0.66
TYK2 P29597 10/20 0.66
STAT3 P40763 7/20 0.66
ABL1 P00519 1/20 0.48
KDR P35968 1/20 0.48
GSK3B P49841 1/20 0.48
AURKB Q96GD4 1/20 0.48

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
SCHEMBL30956478 0.92 JAK3 (0.54) JAK2JAK3JAK1TYK2STAT3
SCHEMBL30956577 0.89 JAK2 (0.53) JAK2JAK3JAK1TYK2STAT3
SCHEMBL30956440 0.89 JAK3 (0.57) JAK2JAK3JAK1TYK2STAT3
SCHEMBL30956481 0.86 JAK3 (0.49) JAK2JAK3JAK1TYK2STAT3
SCHEMBL30956586 0.84 JAK1 (0.60) JAK2JAK3JAK1TYK2STAT3
SCHEMBL22098062 0.84 JAK2 (0.67) JAK2JAK3JAK1TYK2STAT3
SCHEMBL30956533 0.81 JAK2 (0.51) JAK2JAK3JAK1TYK2STAT3
SCHEMBL30956395 0.80 JAK3 (0.44) JAK2JAK3JAK1TYK2STAT3
SCHEMBL30956429 0.80 JAK2 (0.47) JAK2JAK3JAK1TYK2STAT3
SCHEMBL28605522 0.80 JAK3 (0.47) JAK2JAK3JAK1TYK2STAT3

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