SCHEMBL9045950

SCHEMBL9045950

O=C(O)c1c[nH]c2c(-c3ccncc3F)c(F)c(F)cc2c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
TET2 Q6N021 1/20 0.40
TET1 Q8NFU7 1/20 0.40
CSNK2A2 P19784 3/20 0.40
CSNK2B P67870 3/20 0.40
CSNK2A1 P68400 3/20 0.40
CYP1A2 P05177 2/20 0.39
HSD17B10 Q99714 1/20 0.39
TOP2A P11388 2/20 0.39
TOP2B Q02880 2/20 0.39
CDC7 O00311 2/20 0.38
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
MEN1 O00255 1/20 0.37
ALOX12 P18054 1/20 0.37
KMT2A Q03164 1/20 0.37
GUSB P08236 2/20 0.36
DNA2 P51530 1/20 0.36
CASP6 P55212 1/20 0.36
CTDSP1 Q9GZU7 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
SCHEMBL8140106 0.82 KDM4E (0.53) KDM4ETET2TET1CSNK2A2CSNK2B
Hydrochloric Acid SCHEMBL9047371 0.81 TOP2A (0.42) KDM4ECYP1A2HSD17B10TOP2ATOP2B
SCHEMBL9047376 0.81 KDM4E (0.45) KDM4EHSD17B10TOP2AALDH1A1HPGD
Hydrochloric Acid SCHEMBL9044858 0.81 KDM4E (0.44) KDM4EHSD17B10TOP2AALDH1A1HPGD
SCHEMBL9047491 0.79 ALDH1A1 (0.47) TOP2ATOP2BALDH1A1KMT2A
SCHEMBL9045281 0.79 ALDH1A1 (0.47) TOP2ATOP2BALDH1A1KMT2A
Hydrochloric Acid SCHEMBL9049612 0.78 ALDH1A1 (0.46) TOP2ATOP2BALDH1A1KMT2A
SCHEMBL1878010 0.76 KDM4E (0.51) KDM4ETET2TET1CSNK2A2CSNK2B
SCHEMBL10962735 0.74 TOP2A (0.47) KDM4ETET2TET1CSNK2A2CSNK2B
SCHEMBL30307775 0.73 KDM4E (0.49) KDM4ETET2TET1CSNK2A2CSNK2B

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0713487-A1 NOVEL QUINOLONE CARBOXYLIC ACID DERIVATIVES DONG WHA PHARMACEUTICAL INDUSTRIAL CO. LTD. (KR) 1996-05-29 EP disclosed