SCHEMBL10760134

SCHEMBL10760134

CCc1c(F)c(F)cc2c(=O)c(C(=O)O)c[nH]c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 3/20 0.45
HPGD P15428 2/20 0.45
CSNK2A2 P19784 4/20 0.43
CSNK2B P67870 4/20 0.43
CSNK2A1 P68400 4/20 0.43
CYP1A2 P05177 3/20 0.42
HSD17B10 Q99714 1/20 0.42
DNA2 P51530 1/20 0.41
CASP6 P55212 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
HTT P42858 1/20 0.41
LMNA P02545 1/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALOX12 P18054 1/20 0.39
ADRB2 P07550 1/20 0.39
RECQL P46063 1/20 0.39

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
SCHEMBL3718398 0.87 KDM4E (0.43) KDM4EALDH1A1HPGDCSNK2A2CSNK2B
SCHEMBL5194351 0.87 CSNK2A2 (0.50) KDM4EALDH1A1HPGDCSNK2A2CSNK2B
SCHEMBL10768287 0.87 CSNK2A2 (0.44) KDM4EALDH1A1HPGDCSNK2A2CSNK2B
SCHEMBL3812191 0.86 CSNK2A2 (0.49) KDM4EALDH1A1HPGDCSNK2A2CSNK2B
SCHEMBL1878010 0.83 KDM4E (0.51) KDM4EALDH1A1HPGDCSNK2A2CSNK2B
SCHEMBL11020660 0.82 KDM4E (0.42) KDM4EALDH1A1HPGDCSNK2A2CSNK2B
SCHEMBL13484134 0.82 CSNK2A1 (0.56) KDM4EALDH1A1HPGDCSNK2A2CSNK2B
SCHEMBL30307775 0.80 KDM4E (0.49) KDM4EALDH1A1HPGDCSNK2A2CSNK2B
SCHEMBL10914618 0.80 TOP2A (0.47) KDM4EALDH1A1HPGDCSNK2A2CSNK2B
SCHEMBL5043939 0.79 KDM4E (0.50) KDM4EALDH1A1HPGDCYP1A2HSD17B10

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-0215650-A2 Substituted bridged-diazabicycloalkyl quinolone carboxylic acids PFIZER INC. (US) 1987-03-25 EP disclosed
EP-0153163-A2 7-Substituted-1-cyclopropyl-6,8-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acids; 7-substituted-1-cyclopropyl-1,4-dihydro-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acids; their derivatives; and a process for preparing the compounds WARNER-LAMBERT COMPANY (US) 1985-08-28 EP disclosed
EP-0106489-A2 Antibacterial agents WARNER-LAMBERT COMPANY (US) 1984-04-25 EP disclosed