SCHEMBL30956483

SCHEMBL30956483

COC(=O)c1ccccc1-c1nc(Nc2cnn(CC#N)c2)ncc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K7 O43318 2/20 0.46
FLT3 P36888 2/20 0.46
MAPK1 P28482 1/20 0.46
MAP2K1 Q02750 1/20 0.46
FLT4 P35916 2/20 0.45
HDAC3 O15379 9/20 0.44
HDAC1 Q13547 9/20 0.44
HDAC6 Q9UBN7 6/20 0.44
CDK7 P50613 4/20 0.44
CDK9 P50750 4/20 0.44
CDK2 P24941 3/20 0.44
JAK2 O60674 8/20 0.43
HDAC4 P56524 4/20 0.43
HDAC7 Q8WUI4 4/20 0.43
HDAC2 Q92769 4/20 0.43
HDAC10 Q969S8 4/20 0.43
HDAC11 Q96DB2 4/20 0.43
HDAC8 Q9BY41 4/20 0.43
HDAC9 Q9UKV0 4/20 0.43
HDAC5 Q9UQL6 4/20 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
SCHEMBL30956533 0.92 JAK2 (0.51) MAP3K7FLT3MAPK1MAP2K1FLT4
SCHEMBL30956429 0.90 JAK2 (0.47) MAP3K7FLT3MAPK1MAP2K1FLT4
SCHEMBL30956485 0.89 JAK3 (0.44) JAK2JAK3JAK1TYK2
SCHEMBL30956566 0.89 HDAC3 (0.44) MAP3K7FLT3MAPK1MAP2K1FLT4
SCHEMBL30956424 0.87 MAP3K7 (0.58) MAP3K7FLT3MAPK1MAP2K1FLT4
SCHEMBL30956385 0.84 CDK2 (0.58) MAP3K7MAPK1MAP2K1FLT4CDK7
SCHEMBL24853518 0.84 JAK3 (0.46) MAP3K7FLT3MAPK1MAP2K1HDAC3
SCHEMBL30956577 0.82 JAK2 (0.53) FLT4HDAC3HDAC1HDAC6CDK7
SCHEMBL30956585 0.81 CDK2 (0.55) MAP3K7MAPK1MAP2K1FLT4CDK7
SCHEMBL30956478 0.81 JAK3 (0.54) JAK2JAK3JAK1TYK2

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