SCHEMBL30956400

SCHEMBL30956400

Cn1cc(Nc2nccc(-c3ccc(C(N)=O)c(CC#N)c3F)n2)cn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 14/20 0.52
▸ JAK3 P52333 14/20 0.52
▸ TYK2 P29597 10/20 0.52
▸ JAK2 O60674 8/20 0.52
▸ STAT3 P40763 1/20 0.52
▸ BTK Q06187 1/20 0.48
▸ MAP3K14 Q99558 1/20 0.43
▸ KDR P35968 1/20 0.43
▸ AURKB Q96GD4 1/20 0.43
▸ CDC7 O00311 2/20 0.43
▸ DAPK3 O43293 2/20 0.43
▸ ROCK2 O75116 2/20 0.43
▸ PRKD3 O94806 2/20 0.43
▸ MAP4K4 O95819 2/20 0.43
▸ PAK4 O96013 2/20 0.43
▸ PIM1 P11309 2/20 0.43
▸ PRKACA P17612 2/20 0.43
▸ CDK2 P24941 2/20 0.43
▸ SYK P43405 2/20 0.43
▸ CSNK1A1 P48729 2/20 0.43

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
SCHEMBL30956377 0.82 JAK3 (0.51) JAK1JAK3TYK2JAK2MAP3K14
SCHEMBL30956457 0.81 JAK3 (0.53) JAK1JAK3TYK2JAK2STAT3
SCHEMBL30956638 0.80 JAK1 (0.51) JAK1JAK3TYK2JAK2STAT3
SCHEMBL27228451 0.76 JAK3 (0.46) JAK1JAK3TYK2JAK2STAT3
SCHEMBL27228636 0.75 JAK3 (0.47) JAK1JAK3TYK2JAK2STAT3
SCHEMBL29901157 0.75 JAK3 (0.47) JAK1JAK3TYK2JAK2STAT3
SCHEMBL22097650 0.75 JAK2 (0.53) JAK1JAK3TYK2JAK2STAT3
SCHEMBL29941570 0.75 JAK2 (0.53) JAK1JAK3TYK2JAK2STAT3
SCHEMBL30956519 0.75 JAK1 (0.51) JAK1JAK3TYK2JAK2STAT3
SCHEMBL23275876 0.73 BTK (0.49) JAK1JAK3TYK2JAK2STAT3

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
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