SCHEMBL7017453

SCHEMBL7017453

O=C(O)c1cn(-c2ccc(F)cc2)c2cc(-c3ccc4c(c3)CNC4)c(F)cc2c1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.58
KDM4E B2RXH2 5/20 0.58
ALDH1A1 P00352 4/20 0.58
HPGD P15428 3/20 0.58
HSD17B10 Q99714 3/20 0.58
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
CAPN1 P07384 2/20 0.42
PIM1 P11309 2/20 0.41
POLB P06746 1/20 0.38
HSP90AA1 P07900 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
TOP1 P11387 2/20 0.37
CYP1A2 P05177 2/20 0.36
TOP2A P11388 1/20 0.36
CYP2C9 P11712 1/20 0.36
TOP2B Q02880 1/20 0.36
BRD4 O60885 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 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
SCHEMBL7008289 0.93 ALDH1A1 (0.50) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7010759 0.89 ALDH1A1 (0.49) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7014319 0.86 LMNA (0.63) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL10518008 0.83 LMNA (0.58) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7011787 0.83 ALDH1A1 (0.40) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7010745 0.82 TOP2A (0.48) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7006628 0.82 TOP2A (0.56) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7008949 0.82 ALDH1A1 (0.55) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7015354 0.82 HPGD (0.56) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7007009 0.81 LMNA (0.47) 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