SCHEMBL7015679

SCHEMBL7015679

O=C(O)c1cn(CCF)c2c(Cl)c(-c3ccc4c(c3)CNC4)c(F)cc2c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 4/20 0.43
TOP2A P11388 6/20 0.41
TOP2B Q02880 6/20 0.41
CHRM1 P11229 1/20 0.39
TOP1 P11387 5/20 0.39
DRD3 P35462 1/20 0.38
HPGD P15428 3/20 0.37
HSD17B10 Q99714 3/20 0.37
LMNA P02545 2/20 0.37
BRD4 O60885 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
CYP2J2 P51589 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CYP2C9 P11712 1/20 0.36
ATP6V1B2 P21281 1/20 0.36
TBXA2R P21731 1/20 0.36
EDNRA P25101 1/20 0.36
TARBP2 Q15633 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
SCHEMBL7010036 0.91 KDM4E (0.46) KDM4EALDH1A1TOP2ATOP2BCHRM1
SCHEMBL7005857 0.91 KDM4E (0.56) KDM4EALDH1A1TOP2ATOP2BCHRM1
SCHEMBL7004815 0.89 KDM4E (0.52) KDM4EALDH1A1TOP2ATOP2BTOP1
SCHEMBL7013895 0.87 KDM4E (0.55) KDM4EALDH1A1TOP2ATOP2BCHRM1
SCHEMBL7004763 0.86 KDM4E (0.50) KDM4EALDH1A1TOP2ATOP2BTOP1
SCHEMBL7007995 0.83 TOP2A (0.60) KDM4EALDH1A1TOP2ATOP2BCHRM1
SCHEMBL7011692 0.83 LMNA (0.47) KDM4EALDH1A1TOP2ATOP2BHPGD
SCHEMBL7014477 0.82 TOP2A (0.48) KDM4EALDH1A1TOP2ATOP2BHPGD
SCHEMBL7010327 0.82 TOP2A (0.46) KDM4EALDH1A1TOP2ATOP2BCHRM1
SCHEMBL8322753 0.82 TOP2A (0.46) KDM4EALDH1A1TOP2ATOP2BCHRM1

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