SCHEMBL30401646

SCHEMBL30401646

COC(=O)c1cccc2c(=O)[nH]cnc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 6/20 0.56
MAP2K1 Q02750 2/20 0.53
PIM1 P11309 2/20 0.53
AURKA O14965 1/20 0.53
DAPK3 O43293 1/20 0.53
JAK2 O60674 1/20 0.53
PRKD3 O94806 1/20 0.53
MAP4K4 O95819 1/20 0.53
PAK4 O96013 1/20 0.53
ABL1 P00519 1/20 0.53
CSF1R P07333 1/20 0.53
RET P07949 1/20 0.53
IGF1R P08069 1/20 0.53
MET P08581 1/20 0.53
PDGFRB P09619 1/20 0.53
FGFR1 P11362 1/20 0.53
PDGFRA P16234 1/20 0.53
PRKACA P17612 1/20 0.53
FLT1 P17948 1/20 0.53
LTK P29376 1/20 0.53

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
SCHEMBL666431 1.00 PARP1 (0.56) PARP1MAP2K1PIM1AURKADAPK3
SCHEMBL25433958 0.83 PARP1 (0.61) PARP1MAP2K1PIM1AURKADAPK3
SCHEMBL667427 0.81 PARP1 (0.58) PARP1MAP2K1PIM1AURKADAPK3
SCHEMBL2519442 0.80 PARP1 (0.64) PARP1MAP2K1PIM1AURKADAPK3
SCHEMBL536589 0.80 PARP1 (0.64) PARP1NR4A2CREBBP
SCHEMBL30401648 0.79 AXL (0.41) PARP1MAP2K1PIM1AURKADAPK3
SCHEMBL24399568 0.79 AXL (0.41) PARP1MAP2K1PIM1AURKADAPK3
SCHEMBL24399628 0.78 PARP1 (0.59) PARP1MAP2K1PIM1RPS6KA3ALK
SCHEMBL29393199 0.78 MAP2K1 (0.65) MAP2K1PSMD14NR4A2CREBBPKDM4E
SCHEMBL24399553 0.77 BCL2 (0.47) PARP1MAP2K1ALKIP6K1KDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025228828-A1 CARBOXAMIDE COMPOUNDS FOR THE TREATMENT AND PREVENTION OF VIRAL DISEASES MERCK PATENT GMBH (DE) 2025-11-06 WO disclosed
CN-117126140-A Heterocyclic compounds having protein kinase inhibitory activity, pharmaceutical compositions containing the same, and methods of preparing and using the same 四川科伦博泰生物医药股份有限公司 2023-11-28 CN disclosed
CN-116096718-A Aryl amide compound, pharmaceutical composition containing same, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2023-05-09 CN disclosed