SCHEMBL30956596

SCHEMBL30956596

COC(=O)c1ccccc1-c1nc(Nc2cnn(C3CC3)c2)ncc1C(F)F

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 18/20 0.51
JAK1 P23458 13/20 0.51
JAK2 O60674 12/20 0.49
TYK2 P29597 5/20 0.49
MAP3K7 O43318 1/20 0.45
MAPK1 P28482 1/20 0.45
MAP2K1 Q02750 1/20 0.45
NUAK1 O60285 1/20 0.45

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
SCHEMBL30956525 0.93 JAK3 (0.50) JAK3JAK1JAK2TYK2
SCHEMBL30956373 0.90 JAK3 (0.53) JAK3JAK1JAK2TYK2
SCHEMBL30956450 0.88 JAK3 (0.51) JAK3JAK1JAK2TYK2MAP3K7
SCHEMBL30956585 0.87 CDK2 (0.55) JAK3JAK1JAK2TYK2MAP3K7
SCHEMBL30956565 0.85 JAK3 (0.51) JAK3JAK1JAK2TYK2
SCHEMBL30956404 0.85 JAK1 (0.51) JAK3JAK1JAK2TYK2MAP3K7
SCHEMBL24853373 0.84 IGF1R (0.46) JAK3JAK1JAK2TYK2MAP3K7
SCHEMBL24852482 0.84 JAK3 (0.46) JAK3JAK1JAK2TYK2
SCHEMBL30956526 0.84 JAK3 (0.47) JAK3JAK1JAK2TYK2NUAK1
SCHEMBL30956612 0.84 JAK3 (0.49) JAK3JAK1JAK2TYK2NUAK1

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