SCHEMBL15971303

SCHEMBL15971303

Nc1ccc(F)c(C(F)(F)F)c1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.40
HSD17B10 Q99714 3/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 1/20 0.40
KEAP1 Q14145 1/20 0.39
HTT P42858 1/20 0.37
KMT2A Q03164 3/20 0.33
GFER P55789 2/20 0.33
RXFP1 Q9HBX9 1/20 0.33
MEN1 O00255 2/20 0.33
CFTR P13569 2/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
USP2 O75604 1/20 0.32

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
SCHEMBL10717546 0.84 CES1 (0.38) ALDH1A1HTTTSHRSMN1; SMN2RXRA
SCHEMBL31146135 0.84 THRB (0.35) KDM4EHSD17B10ALDH1A1HPGDKEAP1
SCHEMBL19687793 0.80 KDM4E (0.39) KDM4EHSD17B10ALDH1A1HPGDKEAP1
SCHEMBL24805151 0.80 KDM4E (0.39) KDM4EHSD17B10ALDH1A1HPGDKEAP1
SCHEMBL21750024 0.78 KEAP1 (0.45) KDM4EHSD17B10ALDH1A1HPGDKEAP1
SCHEMBL2203971 0.76 KEAP1 (0.44) KDM4EHSD17B10ALDH1A1KEAP1KMT2A
SCHEMBL16416613 0.73 KEAP1 (0.46) KDM4EHSD17B10ALDH1A1HPGDKEAP1
SCHEMBL15978622 0.73 CYP3A4 (0.41) KDM4EHSD17B10ALDH1A1KEAP1KMT2A
SCHEMBL15352673 0.73 KEAP1 (0.41) KDM4EHSD17B10ALDH1A1KEAP1KMT2A
SCHEMBL9769391 0.73 HSD17B10 (0.39) KDM4EHSD17B10ALDH1A1HPGDKEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025085233-A1 NOVEL DERIVATIVES OF QUINOLINONES, AND COMPOSITIONS AND METHODS THEREOF ENSEM THERAPEUTICS, INC. (US) 2025-04-24 WO disclosed
WO-2014128612-A1 QUINAZOLIN-4-ONE DERIVATIVES NOVARTIS AG (CH) 2014-08-28 WO disclosed