SCHEMBL8129860

SCHEMBL8129860

CCOC(=O)c1cn(-c2ccc(F)cc2F)c2nc(N3CCC(n4ccnn4)C3)c(F)cc2c1=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.58
▸ EPHA2 P29317 1/20 0.50
▸ FLT4 P35916 1/20 0.50
▸ GSK3B P49841 1/20 0.50
▸ RARB P10826 1/20 0.50
▸ TBXAS1 P24557 1/20 0.50
▸ SLC6A3 Q01959 1/20 0.50
▸ KDM4E B2RXH2 4/20 0.48
▸ HPGD P15428 4/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ HSD17B10 Q99714 3/20 0.48
▸ LMNA P02545 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ XBP1 P17861 1/20 0.48
▸ NFKB1 P19838 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ NFKB2 Q00653 1/20 0.48
▸ RELA Q04206 1/20 0.48
▸ MAPT P10636 1/20 0.38
▸ THRB P10828 1/20 0.38

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
SCHEMBL8131336 0.89 KMT2A (0.71) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL8133502 0.87 DPP4 (0.47) KMT2AKDM4EHSD17B10LMNADPP4
SCHEMBL8133506 0.87 DPP4 (0.47) KMT2AKDM4EHSD17B10LMNADPP4
SCHEMBL10552247 0.86 KMT2A (0.79) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL9603754 0.84 DPP4 (0.51) KMT2AKDM4EHPGDALDH1A1HSD17B10
SCHEMBL9603753 0.84 DPP4 (0.51) KMT2AKDM4EHPGDALDH1A1HSD17B10
SCHEMBL10547292 0.84 KMT2A (0.61) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL9597618 0.83 DPP4 (0.43) KMT2AKDM4EALDH1A1HSD17B10LMNA
SCHEMBL5868714 0.82 KMT2A (0.66) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL9293429 0.82 DPP4 (0.46) KMT2AKDM4EHPGDALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0561850-B1 7-SUBSTITUTED-6-FLUORO-1,4-DIHYDRO-4-OXO-QUINOLINE-3-CARBOXYLIC ACID COMPOUNDS USEFUL AS ANTIBACTERIAL AGENTS NAEJA PHARMACEUTICAL INC (CA) 2000-07-12 — — EP disclosed
US-5342846-A 7-substituted-6-fluoro-1,4-dihydro-4-oxo-quinoline-3-carboxylic acid compounds and 7-(substituted triazolyl pyrrolidin-1-yl) 4-oxoquinoline-3-carboxylic acid derivatives useful as antibacterial agents SYNPHAR LABORATORIES, INC. (CA) 1994-08-30 — — US disclosed
WO-1993024481-A1 7-SUBSTITUTED-6-FLUORO-1,4-DIHYDRO-4-OXO-QUINOLINE-3-CARBOXYLIC ACID COMPOUNDS AND RELATED COMPOUNDS AS ANTIBACTERIAL AGENTS SYNPHAR LABORATORIES, INC. (CA) 1993-12-09 — — WO disclosed
EP-0561850-A1 7-SUBSTITUTED-6-FLUORO-1,4-DIHYDRO-4-OXO-QUINOLINE-3-CARBOXYLIC ACID COMPOUNDS USEFUL AS ANTIBACTERIAL AGENTS SYNPHAR LABORATORIES INC. (CA) 1993-09-29 — — EP disclosed
WO-1992010492-A1 7-SUBSTITUTED-6-FLUORO-1,4-DIHYDRO-4-OXO-QUINOLINE-3-CARBOXYLIC ACID COMPOUNDS USEFUL AS ANTIBACTERIAL AGENTS SYNPHAR LABORATORIES, INC. (CA) 1992-06-25 — — WO disclosed
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