SCHEMBL30956502

SCHEMBL30956502

COC(=O)c1ncccc1-c1nc(Nc2cnn(C3CCNCC3)c2)ncc1C

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NUAK1 O60285 6/20 0.51
FGFR1 P11362 1/20 0.50
FGFR2 P21802 1/20 0.50
FGFR4 P22455 1/20 0.50
FGFR3 P22607 1/20 0.50
EIF2AK4 Q9P2K8 4/20 0.48
AURKB Q96GD4 2/20 0.47
AURKC Q9UQB9 1/20 0.47
FLT4 P35916 5/20 0.46
JAK3 P52333 3/20 0.46
JAK1 P23458 2/20 0.46
JAK2 O60674 2/20 0.45
PTK2 Q05397 1/20 0.45
KDR P35968 3/20 0.44
NUAK2 Q9H093 1/20 0.43
TYK2 P29597 1/20 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
SCHEMBL30956547 0.94 JAK3 (0.46) NUAK1FGFR1FGFR2FGFR4FGFR3
Hydrochloric Acid SCHEMBL30956501 0.88 NUAK1 (0.55) NUAK1FGFR1FGFR2FGFR4FGFR3
SCHEMBL30956414 0.88 IGF1R (0.45) FGFR1FGFR2FGFR4FGFR3FLT4
SCHEMBL30956448 0.87 JAK3 (0.53) FLT4JAK3JAK2PTK2
SCHEMBL30956609 0.85 JAK1 (0.47) NUAK1EIF2AK4FLT4JAK3JAK1
SCHEMBL30956380 0.84 IGF1R (0.51) NUAK1FGFR1FGFR2FGFR4FGFR3
SCHEMBL30956437 0.84 NUAK1 (0.57) NUAK1EIF2AK4AURKBAURKCFLT4
SCHEMBL22097956 0.83 NUAK1 (0.48) NUAK1FGFR1FGFR2FGFR4FGFR3
SCHEMBL30956450 0.82 JAK3 (0.51) NUAK1AURKBAURKCFLT4JAK3
Hydrochloric Acid SCHEMBL31557685 0.82 NUAK1 (0.47) NUAK1FGFR1FGFR2FGFR4FGFR3

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