SCHEMBL30956465

SCHEMBL30956465

CCOC(=O)c1ccccc1-c1nc(Nc2cn[nH]c2)ncc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.46
MAPT P10636 1/20 0.46
FLT4 P35916 2/20 0.46
PTK2 Q05397 1/20 0.44
CDK2 P24941 5/20 0.42
AURKA O14965 3/20 0.42
JAK2 O60674 3/20 0.42
JAK3 P52333 3/20 0.42
MAPK1 P28482 1/20 0.42
CCNA2 P20248 3/20 0.42
RAB9A P51151 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALDH1A1 P00352 1/20 0.42
PKM P14618 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CDK4 P11802 2/20 0.42
CCND3 P30281 2/20 0.42
CCNA1 P78396 1/20 0.42
CDK6 Q00534 1/20 0.42
KDR P35968 1/20 0.41

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
SCHEMBL30956529 0.91 FLT4 (0.46) FLT4PTK2CDK2AURKAJAK2
SCHEMBL30827949 0.87 AURKA (0.47) FLT4PTK2CDK2AURKAJAK2
SCHEMBL30956538 0.82 JAK2 (0.45) FLT4PTK2CDK2AURKAJAK2
SCHEMBL22097684 0.81 MEN1 (0.47) MAPTFLT4CDK2AURKAJAK2
SCHEMBL28611273 0.75 CDK2 (0.43) FLT4PTK2CDK2AURKAJAK2
SCHEMBL30956630 0.74 FLT4 (0.48) FLT4AURKAJAK2JAK3KDR
SCHEMBL24852536 0.73 CDK2 (0.48) FLT4CDK2AURKAJAK2JAK3
SCHEMBL30956572 0.72 JAK1 (0.58) FLT4CDK2JAK2JAK3KDR
SCHEMBL22097654 0.72 AURKA (0.46) FLT4CDK2AURKAJAK2JAK3
SCHEMBL30956505 0.71 CDK2 (0.39) FLT4PTK2CDK2AURKAJAK2

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