SCHEMBL7007733

SCHEMBL7007733

CCOC(=O)c1cn(-c2cc(N)c(F)c(F)c2F)c2cc(F)c(F)cc2c1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.55
STAT3 P40763 2/20 0.48
HTT P42858 1/20 0.48
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 3/20 0.47
HPGD P15428 3/20 0.47
HSD17B10 Q99714 3/20 0.47
PIM1 P11309 1/20 0.44
IRAK1 P51617 1/20 0.44
CAMK2B Q13554 1/20 0.44
CAMK2G Q13555 1/20 0.44
CAMK2D Q13557 1/20 0.44
PIM3 Q86V86 1/20 0.44
ROCK2 O75116 1/20 0.43
CDK1 P06493 1/20 0.43
PRKACA P17612 1/20 0.43
CDK2 P24941 1/20 0.43
CSNK1D P48730 1/20 0.43
GSK3A P49840 1/20 0.43
CDK5 Q00535 1/20 0.43

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
SCHEMBL7005217 0.88 KMT2A (0.56) KMT2ASTAT3HTTALDH1A1KDM4E
SCHEMBL7008142 0.85 KMT2A (0.53) KMT2ASTAT3HTTALDH1A1KDM4E
SCHEMBL7011336 0.84 ALDH1A1 (0.55) KMT2ASTAT3HTTALDH1A1KDM4E
SCHEMBL7010639 0.83 TOP1 (0.45) KMT2ASTAT3HTTALDH1A1KDM4E
SCHEMBL7008404 0.83 STAT3 (0.45) KMT2ASTAT3HTTALDH1A1KDM4E
SCHEMBL19728640 0.82 KMT2A (0.50) KMT2ASTAT3HTTALDH1A1KDM4E
SCHEMBL5258973 0.81 KMT2A (0.57) KMT2ASTAT3HTTALDH1A1KDM4E
SCHEMBL9045088 0.80 KMT2A (0.54) KMT2ASTAT3HTTALDH1A1KDM4E
SCHEMBL29008041 0.80 PIM1 (0.59) KMT2ASTAT3HTTALDH1A1KDM4E
SCHEMBL7006600 0.78 KMT2A (0.54) KMT2ASTAT3HTTALDH1A1KDM4E

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