SCHEMBL8469433

SCHEMBL8469433

CC(O)Cc1ccc(F)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.39
ALOX12 P18054 3/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 2/20 0.39
ESR1 P03372 2/20 0.39
TP53 P04637 2/20 0.39
CYP3A4 P08684 2/20 0.39
HPGD P15428 2/20 0.39
MAPK1 P28482 2/20 0.39
RECQL P46063 2/20 0.39
KMT2A Q03164 2/20 0.39
HIF1A Q16665 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TRPA1 O75762 2/20 0.39
NR1I2 O75469 1/20 0.39
GMNN O75496 1/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
NR3C1 P04150 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
SCHEMBL19404310 1.00 ALOX15 (0.39) ALOX15ALOX12ALDH1A1KDM4EMEN1
SCHEMBL2623873 0.83 GABRA1 (0.48) ALOX15ALOX12ALDH1A1KDM4EMEN1
SCHEMBL9176216 0.83 GABRA1 (0.48) ALOX15ALOX12ALDH1A1KDM4EMEN1
SCHEMBL22122818 0.82 PNMT (0.46) ALOX15ALOX12ALDH1A1KDM4EMEN1
SCHEMBL22122819 0.82 PNMT (0.46) ALOX15ALOX12ALDH1A1KDM4EMEN1
SCHEMBL22145308 0.82 PNMT (0.46) ALOX15ALOX12ALDH1A1KDM4EMEN1
SCHEMBL28747785 0.82 PNMT (0.46) KDM4EMEN1CYP3A4KMT2ALMNA
SCHEMBL14402555 0.82 RIPK1 (0.41) ALDH1A1CYP3A4DPP4MAOAMAOB
SCHEMBL27835674 0.80 FOS (0.51) ALOX15ALOX12CYP3A4NR3C1FOS
SCHEMBL27853740 0.80 FOS (0.51) ALOX15ALOX12CYP3A4NR3C1FOS

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
WO-1999048530-A1 COMBINATION THERAPY FOR THE TREATMENT OF BENIGN PROSTATIC HYPERPLASIA MERCK & CO., INC. (US) 1999-09-30 WO disclosed