SCHEMBL7008835

SCHEMBL7008835

Cc1cc(-c2cc3c(cc2F)c(=O)c(C(=O)O)cn3C2CC2)cc2c1CNC2

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 6/20 0.53
TOP2B Q02880 6/20 0.53
KDM4E B2RXH2 4/20 0.53
ALDH1A1 P00352 4/20 0.53
LMNA P02545 3/20 0.53
HPGD P15428 2/20 0.53
HSD17B10 Q99714 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C9 P11712 1/20 0.53
MAPT P10636 1/20 0.49
PIK3CG P48736 5/20 0.43
PIK3CD O00329 3/20 0.43
PIK3R1 P27986 3/20 0.43
PIK3CA P42336 3/20 0.43
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL7006088 0.93 TOP2A (0.56) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL7006628 0.85 TOP2A (0.56) TOP2ATOP2BKDM4EALDH1A1LMNA
Bromide SCHEMBL7012863 0.84 TOP2A (0.56) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL7006195 0.81 TOP2A (0.55) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL7006246 0.81 TOP2A (0.58) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL7866482 0.81 TOP2A (0.67) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL7010658 0.80 TOP2A (0.57) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL4996744 0.79 TOP2A (0.52) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL4998670 0.78 TOP2A (0.52) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL5001621 0.78 TOP2A (0.49) TOP2ATOP2BKDM4EALDH1A1LMNA

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