SCHEMBL7006573

SCHEMBL7006573

CCOC(=O)c1cn(-c2c(F)cc(F)cc2F)c2c(Cl)c(F)c(F)cc2c1=O

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 4/20 0.61
HTT P42858 1/20 0.46
KDM4E B2RXH2 3/20 0.46
HPGD P15428 3/20 0.46
KMT2A Q03164 2/20 0.46
CYP2C19 P33261 1/20 0.46
ALDH1A1 P00352 3/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
ADRB2 P07550 1/20 0.42
NPC1 O15118 1/20 0.41
HSD17B10 Q99714 2/20 0.41
POLB P06746 1/20 0.39
BAZ2B Q9UIF8 1/20 0.39
BAZ2A Q9UIF9 1/20 0.39
CMA1 P23946 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
SCHEMBL7005983 0.87 HTT (0.56) STAT3HTTKDM4EHPGDKMT2A
SCHEMBL7004211 0.87 STAT3 (0.53) STAT3HTTKDM4EHPGDKMT2A
SCHEMBL7004323 0.85 STAT3 (0.54) STAT3HTTKDM4EHPGDKMT2A
SCHEMBL7010606 0.84 STAT3 (0.55) STAT3HTTKDM4EHPGDKMT2A
SCHEMBL7004096 0.84 STAT3 (0.52) STAT3HTTKDM4EHPGDKMT2A
SCHEMBL7011343 0.84 STAT3 (0.52) STAT3HTTKDM4EHPGDKMT2A
SCHEMBL7004678 0.83 CYP3A4 (0.48) STAT3KDM4EHPGDKMT2AALDH1A1
SCHEMBL5528631 0.82 HTT (0.53) STAT3HTTKDM4EHPGDKMT2A
SCHEMBL7011670 0.82 STAT3 (0.53) STAT3HTTKDM4EHPGDKMT2A
SCHEMBL10766493 0.82 STAT3 (0.54) STAT3HTTKDM4EHPGDKMT2A

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
EP-0787720-B1 PYRIDONECARBOXYLATE DERIVATIVE OR SALT THEREOF AND ANTIBACTERIAL CONTAINING THE SAME AS ACTIVE INGREDIENT WAKUNAGA SEIYAKU KK (JP) 2003-07-16 EP disclosed
US-5910498-A NOVEL COMPOUNDS HAVING REDUCED CYTOTOXICITY, PHOTOTOXICITY; TREATING BACTERIAL AND VIRAL INFECTIONS WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1999-06-08 US disclosed
EP-0787720-A1 NOVEL PYRIDONECARBOXYLATE DERIVATIVE OR SALT THEREOF AND ANTIBACTERIAL CONTAINING THE SAME AS ACTIVE INGREDIENT WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1997-08-06 EP disclosed