SCHEMBL8208899

SCHEMBL8208899

Cc1ccccc1/C(=C\C(F)(F)F)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 1/20 0.45
FEN1 P39748 1/20 0.45
HPGD P15428 2/20 0.42
GPR52 Q9Y2T5 1/20 0.39
MYC P01106 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 1/20 0.38
ALOX12 P18054 1/20 0.37
HTT P42858 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 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
SCHEMBL8208906 1.00 ERCC5 (0.45) ERCC5FEN1HPGDGPR52MYC
SCHEMBL9464464 0.80 ERCC5 (0.52) ERCC5FEN1HPGDGPR52MYC
SCHEMBL9333335 0.78 ERCC5 (0.50) ERCC5FEN1HPGDGPR52MYC
SCHEMBL9333326 0.78 ERCC5 (0.50) ERCC5FEN1HPGDGPR52MYC
SCHEMBL9563141 0.77 ERCC5 (0.49) ERCC5FEN1HPGDGPR52MYC
SCHEMBL7146890 0.76 AKR1C1 (0.53) KMT2AMEN1KDM4EALDH1A1HSD17B10
SCHEMBL8201571 0.76 FOLH1 (0.33) ERCC5FEN1HPGDSMN1; SMN2ALDH1A1
SCHEMBL8201573 0.76 FOLH1 (0.33) ERCC5FEN1HPGDSMN1; SMN2ALDH1A1
SCHEMBL9493449 0.74 KMT2A (0.46) ERCC5FEN1HPGDGPR52MYC
SCHEMBL7770355 0.74 ERCC5 (0.46) ERCC5FEN1HPGDGPR52MYC

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
EP-1021399-A2 FUNGICIDES WITH HYDROXIMIC AND HYDRAZONIC GROUPS AVENTIS CROPSCIENCE S.A. (FR) 2000-07-26 EP disclosed
WO-1998015512-A2 FUNGICIDES WITH HYDROXIMIC AND HYDRAZONIC GROUPS RHONE POULENC AGROCHIMIE (FR) 1998-04-16 WO disclosed