SCHEMBL30956437

SCHEMBL30956437

Cc1cnc(Nc2cnn(C3CCNCC3)c2)nc1-c1ccccc1C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NUAK1 O60285 5/20 0.57
JAK3 P52333 5/20 0.53
JAK1 P23458 5/20 0.53
AURKB Q96GD4 2/20 0.53
AURKC Q9UQB9 1/20 0.53
FLT4 P35916 7/20 0.51
JAK2 O60674 4/20 0.49
TYK2 P29597 2/20 0.49
KDR P35968 3/20 0.49
NUAK2 Q9H093 1/20 0.48
PTK2 Q05397 1/20 0.46
EIF2AK4 Q9P2K8 1/20 0.46

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
SCHEMBL30956567 0.93 JAK3 (0.54) NUAK1JAK3JAK1FLT4JAK2
SCHEMBL30956513 0.91 JAK3 (0.51) NUAK1JAK3JAK1FLT4JAK2
SCHEMBL30956557 0.91 FLT4 (0.47) NUAK1JAK3JAK1AURKBAURKC
Hydrochloric Acid SCHEMBL30956501 0.90 NUAK1 (0.55) NUAK1JAK3JAK1AURKBAURKC
SCHEMBL30956439 0.90 JAK3 (0.51) NUAK1JAK3JAK1FLT4JAK2
SCHEMBL30956558 0.89 JAK3 (0.62) JAK3JAK1JAK2TYK2
SCHEMBL30956433 0.89 JAK3 (0.49) NUAK1JAK3JAK1AURKBAURKC
SCHEMBL30956615 0.89 FLT4 (0.55) JAK3JAK1FLT4JAK2TYK2
SCHEMBL30956486 0.88 JAK3 (0.49) NUAK1JAK3JAK1FLT4JAK2
SCHEMBL30956438 0.88 JAK3 (0.48) NUAK1JAK3JAK1FLT4JAK2

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