SCHEMBL7011670

SCHEMBL7011670

CCOC(=O)c1cn(-c2ccc(Cl)cc2F)c2c(Cl)c(F)c(F)cc2c1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 3/20 0.53
HTT P42858 1/20 0.48
KDM4E B2RXH2 4/20 0.46
HPGD P15428 3/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 4/20 0.43
HSD17B10 Q99714 2/20 0.43
NPC1 O15118 1/20 0.42
POLB P06746 1/20 0.41
HSP90AA1 P07900 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
PIM1 P11309 1/20 0.40
IRAK1 P51617 1/20 0.40
CAMK2B Q13554 1/20 0.40
CAMK2G Q13555 1/20 0.40
CAMK2D Q13557 1/20 0.40
PIM3 Q86V86 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL7004211 0.92 STAT3 (0.53) STAT3HTTKDM4EHPGDCYP2C19
SCHEMBL7011343 0.87 STAT3 (0.52) STAT3HTTKDM4EHPGDCYP2C19
SCHEMBL7004096 0.87 STAT3 (0.52) STAT3HTTKDM4EHPGDCYP2C19
SCHEMBL7005352 0.85 STAT3 (0.51) STAT3HTTKDM4EHPGDCYP2C19
SCHEMBL7006394 0.85 STAT3 (0.51) STAT3HTTKDM4EHPGDCYP2C19
SCHEMBL7007759 0.85 STAT3 (0.52) STAT3HTTKDM4EHPGDCYP2C19
SCHEMBL5523944 0.85 STAT3 (0.47) STAT3HTTKDM4EHPGDCYP2C19
SCHEMBL19728615 0.85 STAT3 (0.50) STAT3HTTKDM4EHPGDCYP2C19
SCHEMBL7005983 0.85 HTT (0.56) STAT3HTTKDM4EHPGDCYP2C19
SCHEMBL9871156 0.83 HTT (0.62) STAT3HTTKDM4EHPGDCYP2C19

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 2 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