SCHEMBL7008404

SCHEMBL7008404

CCOC(=O)c1cn(-c2cc(N)c(F)c(F)c2F)c2nc(Cl)c(F)cc2c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 2/20 0.45
HTT P42858 1/20 0.43
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 3/20 0.41
HPGD P15428 3/20 0.41
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 3/20 0.40
HSD17B10 Q99714 2/20 0.40
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.38
ROCK2 O75116 1/20 0.36
CDK1 P06493 1/20 0.36
PRKACA P17612 1/20 0.36
CDK2 P24941 1/20 0.36
CSNK1D P48730 1/20 0.36
GSK3A P49840 1/20 0.36
CDK5 Q00535 1/20 0.36
PRKCD Q05655 1/20 0.36

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
SCHEMBL7004278 0.89 STAT3 (0.43) STAT3HTTKMT2AKDM4EHPGD
SCHEMBL7008151 0.89 STAT3 (0.43) STAT3HTTKMT2AKDM4EHPGD
SCHEMBL7007493 0.89 STAT3 (0.43) STAT3HTTKMT2AKDM4EHPGD
SCHEMBL7012340 0.85 ALDH1A1 (0.51) STAT3HTTKMT2AKDM4EHPGD
SCHEMBL7014638 0.85 EPHA2 (0.44) STAT3HTTKMT2AKDM4EHPGD
SCHEMBL7005531 0.85 STAT3 (0.47) STAT3HTTKMT2AKDM4EHPGD
SCHEMBL7010668 0.84 KDM4E (0.42) STAT3HTTKMT2AKDM4EHPGD
SCHEMBL7007733 0.83 KMT2A (0.55) STAT3HTTKMT2AKDM4EHPGD
SCHEMBL7008116 0.82 KDM4E (0.46) STAT3HTTKMT2AKDM4EHPGD
SCHEMBL3236130 0.82 KMT2A (0.48) STAT3HTTKMT2AKDM4EHPGD

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