SCHEMBL30956424

SCHEMBL30956424

COCCn1cc(Nc2ncc(Cl)c(-c3ccccc3C(=O)OC)n2)cn1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAP3K7 O43318 2/20 0.58
FLT4 P35916 1/20 0.57
MAPK1 P28482 1/20 0.57
FLT3 P36888 1/20 0.57
MAP2K1 Q02750 1/20 0.57
JAK3 P52333 11/20 0.53
JAK1 P23458 8/20 0.53
JAK2 O60674 7/20 0.53
TYK2 P29597 3/20 0.53
AURKA O14965 1/20 0.53
TTK P33981 1/20 0.53
IGF1R P08069 3/20 0.51
HDAC3 O15379 2/20 0.47
CDK2 P24941 2/20 0.47
CDK7 P50613 2/20 0.47
CDK9 P50750 2/20 0.47
HDAC1 Q13547 2/20 0.47
HDAC6 Q9UBN7 2/20 0.47

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
SCHEMBL30956456 0.93 MAP3K7 (0.58) MAP3K7FLT4MAPK1FLT3MAP2K1
SCHEMBL30956533 0.88 JAK2 (0.51) MAP3K7FLT4MAPK1FLT3MAP2K1
SCHEMBL30956385 0.88 CDK2 (0.58) MAP3K7FLT4MAPK1MAP2K1JAK3
SCHEMBL30956483 0.87 MAP3K7 (0.46) MAP3K7FLT4MAPK1FLT3MAP2K1
SCHEMBL28605509 0.86 MAP3K7 (0.52) MAP3K7FLT4MAPK1FLT3MAP2K1
SCHEMBL24852784 0.84 MAP3K7 (0.55) MAP3K7FLT4MAPK1FLT3MAP2K1
SCHEMBL30956585 0.82 CDK2 (0.55) MAP3K7FLT4MAPK1MAP2K1JAK3
SCHEMBL30956564 0.82 JAK2 (0.56) MAP3K7FLT3JAK3JAK1JAK2
SCHEMBL30956393 0.81 JAK2 (0.53) MAP3K7FLT4JAK3JAK1JAK2
SCHEMBL30956578 0.81 JAK2 (0.58) FLT4JAK3JAK1JAK2TYK2

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