SCHEMBL6578865

SCHEMBL6578865

CCOC(=O)c1cn(-c2cc(NC=O)c(F)cc2Cl)c2c(C)c(F)c(F)cc2c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 3/20 0.50
KMT2A Q03164 2/20 0.41
HTT P42858 1/20 0.40
KDM4E B2RXH2 3/20 0.39
HPGD P15428 3/20 0.39
CYP2C19 P33261 1/20 0.39
ADRB2 P07550 1/20 0.39
ALDH1A1 P00352 3/20 0.37
HSD17B10 Q99714 2/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
NPC1 O15118 1/20 0.36
MAP2K2 P36507 1/20 0.35
MAP2K1 Q02750 1/20 0.35
POLB P06746 1/20 0.35
PIM1 P11309 1/20 0.35
IRAK1 P51617 1/20 0.35
CAMK2B Q13554 1/20 0.35
CAMK2G Q13555 1/20 0.35
CAMK2D Q13557 1/20 0.35

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
SCHEMBL6580697 0.91 STAT3 (0.52) STAT3KMT2AHTTKDM4EHPGD
SCHEMBL7003690 0.89 STAT3 (0.51) STAT3KMT2AHTTKDM4EHPGD
SCHEMBL7007984 0.88 STAT3 (0.50) STAT3KMT2AHTTKDM4EHPGD
SCHEMBL6578628 0.83 STAT3 (0.52) STAT3KMT2AHTTKDM4EHPGD
SCHEMBL6581474 0.81 STAT3 (0.51) STAT3KMT2AHTTKDM4EHPGD
SCHEMBL7004404 0.79 STAT3 (0.43) STAT3KMT2AHTTKDM4EHPGD
SCHEMBL7011343 0.78 STAT3 (0.52) STAT3KMT2AHTTKDM4EHPGD
SCHEMBL6578888 0.78 STAT3 (0.54) STAT3KMT2AHTTKDM4EHPGD
SCHEMBL7008549 0.77 STAT3 (0.61) STAT3KMT2AHTTKDM4EHPGD
SCHEMBL6576291 0.77 STAT3 (0.47) STAT3KMT2AHTTKDM4EHPGD

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-0897919-B1 NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF AND ANTIBACTERIAL AGENTS CONTAINING THE SAME AS THE ACTIVE INGREDIENT WAKUNAGA PHARMA CO LTD (JP) 2004-06-16 EP disclosed
US-6211375-B1 IMPROVED INTESTINAL ABSORPTION WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 2001-04-03 US disclosed
EP-0897919-A1 NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF AND ANTIBACTERIAL AGENTS CONTAINING THE SAME AS THE ACTIVE INGREDIENT WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 1999-02-24 EP disclosed