SCHEMBL29979612

SCHEMBL29979612

CCOC(=O)c1cn(-c2c(C)cc(F)cc2C)c2nc(Cl)c(F)cc2c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 2/20 0.47
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 3/20 0.43
HPGD P15428 3/20 0.43
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
CYP2C19 P33261 1/20 0.43
HTT P42858 1/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
HSD17B10 Q99714 2/20 0.39
TSHR P16473 2/20 0.39
ROCK2 O75116 1/20 0.38
CDK1 P06493 1/20 0.38
PRKACA P17612 1/20 0.38
CDK2 P24941 1/20 0.38
CSNK1D P48730 1/20 0.38
GSK3A P49840 1/20 0.38
CDK5 Q00535 1/20 0.38

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
SCHEMBL19987083 1.00 STAT3 (0.47) STAT3KMT2AALDH1A1KDM4EHPGD
SCHEMBL7009999 0.93 STAT3 (0.48) STAT3KMT2AALDH1A1KDM4EHPGD
SCHEMBL19971497 0.90 STAT3 (0.46) STAT3KMT2AALDH1A1KDM4EHPGD
SCHEMBL7011454 0.88 ROCK2 (0.47) STAT3KMT2AALDH1A1KDM4EHPGD
SCHEMBL19986908 0.88 ALDH1A1 (0.49) STAT3KMT2AALDH1A1KDM4EHPGD
SCHEMBL19973668 0.86 EPHA2 (0.43) KMT2AALDH1A1KDM4EHPGDLMNA
SCHEMBL29980044 0.86 ALDH1A1 (0.45) STAT3KMT2AALDH1A1KDM4EHPGD
SCHEMBL8091107 0.86 NPC1 (0.48) STAT3KMT2AALDH1A1KDM4EHPGD
SCHEMBL19971528 0.86 ALDH1A1 (0.45) STAT3KMT2AALDH1A1KDM4EHPGD
SCHEMBL7005531 0.85 STAT3 (0.47) STAT3KMT2AALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115554294-A 7-substituted 1-arylnaphthyridine-3-carboxamides and their use 拜耳股份公司 2023-01-03 CN disclosed
CN-115477649-A 7-substituted 1-arylnaphthyridine-3-carboxamides and their use 拜耳股份公司 2022-12-16 CN disclosed
CN-115429798-A 7-substituted 1-arylnaphthyridine-3-carboxamides and their use 拜耳股份公司 2022-12-06 CN disclosed
CN-109689656-B 7-substituted 1-arylnaphthyridine-3-carboxamides and their use 拜耳股份公司 2022-10-04 CN disclosed