SCHEMBL30956589

SCHEMBL30956589

COC(=O)c1ccc(-c2nc(Nc3cnn(C4CCCCN4C(=O)OC(C)(C)C)c3)ncc2Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 3/20 0.40
▸ CDK1 P06493 2/20 0.40
▸ IGF1R P08069 2/20 0.40
▸ CDK9 P50750 2/20 0.40
▸ CDK8 P49336 1/20 0.40
▸ CDK7 P50613 1/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ EGFR P00533 1/20 0.40
▸ JAK2 O60674 2/20 0.39
▸ JAK3 P52333 2/20 0.39
▸ JAK1 P23458 1/20 0.39
▸ KDR P35968 2/20 0.38
▸ PAK1 Q13153 3/20 0.38
▸ PTK2 Q05397 1/20 0.37
▸ AURKB Q96GD4 1/20 0.37
▸ HDAC3 O15379 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ MAPT P10636 1/20 0.37

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
SCHEMBL30956628 0.92 DYRK2 (0.40) IGF1RJAK2JAK3JAK1PTK2
SCHEMBL30956509 0.90 JAK2 (0.42) CDK2CDK1JAK2JAK3KDR
SCHEMBL30956471 0.87 IGF1R (0.41) CDK2CDK1IGF1RCDK9CDK8
SCHEMBL30956458 0.86 DYRK2 (0.42) IGF1RJAK2JAK3JAK1PTK2
SCHEMBL22097740 0.85 IGF1R (0.52) CDK2CDK1IGF1RCDK9CDK8
SCHEMBL28600657 0.81 IGF1R (0.41) IGF1RJAK2JAK3JAK1PTK2
SCHEMBL24853389 0.81 IGF1R (0.52) CDK2CDK1IGF1RCDK9CDK8
SCHEMBL30956515 0.80 JAK2 (0.55) CDK2CDK9JAK2JAK3JAK1
SCHEMBL24852543 0.80 IGF1R (0.54) CDK2CDK1IGF1RCDK9CDK8
SCHEMBL29249023 0.80 FLT4 (0.42) CDK2CDK1IGF1RJAK2JAK3

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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