SCHEMBL7177622

SCHEMBL7177622

CCOC(=O)c1cn(-c2ncc(F)c(NC(C)(C)C)n2)c2c(Cl)c(F)c(F)cc2c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 3/20 0.46
KDM4E B2RXH2 6/20 0.39
KMT2A Q03164 4/20 0.39
HPGD P15428 4/20 0.39
CYP2C19 P33261 1/20 0.39
HTT P42858 1/20 0.38
ADRB2 P07550 1/20 0.37
ALDH1A1 P00352 5/20 0.35
NPC1 O15118 3/20 0.35
HSD17B10 Q99714 3/20 0.35
MAPT P10636 3/20 0.35
FOS P01100 1/20 0.35
JUN P05412 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
NR2F2 P24468 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
MAPK1 P28482 1/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL2925163 0.87 STAT3 (0.48) STAT3KDM4EKMT2AHPGDCYP2C19
SCHEMBL2916260 0.86 STAT3 (0.47) STAT3KDM4EKMT2AHPGDCYP2C19
SCHEMBL7168101 0.86 STAT3 (0.47) STAT3KDM4EKMT2AHPGDCYP2C19
SCHEMBL7851187 0.81 STAT3 (0.47) STAT3KDM4EKMT2AHPGDCYP2C19
SCHEMBL2921621 0.80 STAT3 (0.49) STAT3KDM4EKMT2AHPGDCYP2C19
SCHEMBL7171849 0.80 STAT3 (0.55) STAT3KDM4EKMT2AHPGDCYP2C19
SCHEMBL7857499 0.79 STAT3 (0.50) STAT3KDM4EKMT2AHPGDCYP2C19
SCHEMBL2919185 0.78 STAT3 (0.49) STAT3KDM4EKMT2AHPGDCYP2C19
SCHEMBL7177651 0.77 STAT3 (0.45) STAT3KDM4EKMT2AHPGDCYP2C19
SCHEMBL2919164 0.77 STAT3 (0.48) STAT3KDM4EKMT2AHPGDCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0952151-B1 Intermediates for use in preparing novel pyridonecarboxylic acid derivatives or their salts WAKUNAGA PHARMA CO LTD (JP) 2003-05-28 EP disclosed
EP-0911327-B1 NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR THEIR SALTS AND ANTIBACTERIAL AGENT COMPRISING THE SAME AS THE ACTIVE INGREDIENT WAKUNAGA PHARMA CO LTD (JP) 2001-12-05 EP disclosed
US-6156903-A Pyridonecarboxylic acid derivatives or their salts, and antibacterial agents containing the same as their effective components WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 2000-12-05 US disclosed
US-6133284-A EXCELLENT BACTERICIDAL PROPERTIES AND ORAL ABSORPTION; INFECTIONS FROM GRAMNEGATIVE AND -POSITIVE BACTERIA; INTESTINAL ABSORPTION, METABOLIC STABILITY; SIDE EFFECT REDUCTION; NONPHOTOTOXICITY AND NONCYTOTOXICITY WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 2000-10-17 US disclosed
EP-0992501-A2 Pyridonecarboxylic acid derivatives as antibacterial agents WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 2000-04-12 EP disclosed
US-5998436-A Pyridonecarboxylic acid derivatives or their salts and antibacterial agent comprising the same as the active ingredient WAKUNAGA PHARMACEUTICALS CO., LTD. (JP) 1999-12-07 US disclosed
EP-0952151-A2 Intermediates for use in preparing novel pyridonecarboxylic acid derivatives or their salts WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 1999-10-27 EP disclosed
EP-0911327-A1 NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR THEIR SALTS AND ANTIBACTERIAL AGENT COMPRISING THE SAME AS THE ACTIVE INGREDIENT WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 1999-04-28 EP disclosed