SCHEMBL7006074

SCHEMBL7006074

O=C(O)c1cn(-c2ccc(F)cc2F)c2c(OCF)c(-c3ccc4c(c3)CNC4)c(F)cc2c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
EPHA2 P29317 1/20 0.40
FLT4 P35916 1/20 0.40
GSK3B P49841 1/20 0.40
RARB P10826 1/20 0.40
TBXAS1 P24557 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 2/20 0.38
HSP90AA1 P07900 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
XBP1 P17861 1/20 0.38
NFKB1 P19838 1/20 0.38
HTT P42858 1/20 0.38
NFKB2 Q00653 1/20 0.38

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
SCHEMBL7009073 0.90 EPHA2 (0.41) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7013450 0.90 KDM4E (0.45) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7004859 0.89 EPHA2 (0.40) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7013358 0.88 LMNA (0.44) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7011831 0.87 TOP2A (0.47) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7010750 0.87 EPHA2 (0.43) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7013970 0.86 TOP2A (0.45) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7010854 0.86 EPHA2 (0.43) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7010163 0.86 EPHA2 (0.43) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7006455 0.83 KDM4E (0.43) LMNAKDM4EALDH1A1HPGDHSD17B10

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-0775702-B1 NOVEL QUINOLONE- OR NAPHTHYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO LTD (JP) 2003-07-23 EP disclosed
US-5935952-A ANTIBACTERIAL AGENT TOYAMA CHEMICAL CO., LTD. (JP) 1999-08-10 US disclosed
EP-0775702-A1 NOVEL QUINOLONE- OR NAPHTHYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 1997-05-28 EP disclosed