SCHEMBL9799603

SCHEMBL9799603

ON=C(c1ccc(Cl)c(Cl)c1)C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.49
GAA P10253 2/20 0.49
ALDH1A1 P00352 1/20 0.49
ALOX15 P16050 1/20 0.49
TSHR P16473 2/20 0.45
NPFFR2 Q9Y5X5 2/20 0.40
SRD5A2 P31213 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
RAB9A P51151 1/20 0.37
GRIN2B Q13224 1/20 0.37
NPFFR1 Q9GZQ6 1/20 0.37
TYMP P19971 1/20 0.36
HPGD P15428 2/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL9799599 1.00 HSD17B10 (0.49) HSD17B10GAAALDH1A1ALOX15TSHR
SCHEMBL19743314 0.84 TSHR (0.49) HSD17B10GAAALDH1A1ALOX15TSHR
SCHEMBL19743313 0.84 TSHR (0.49) HSD17B10GAAALDH1A1ALOX15TSHR
SCHEMBL9799912 0.78 GAA (0.58) HSD17B10GAAALDH1A1ALOX15TSHR
SCHEMBL10736396 0.78 GAA (0.58) HSD17B10GAAALDH1A1ALOX15TSHR
SCHEMBL9799906 0.78 GAA (0.58) HSD17B10GAAALDH1A1ALOX15TSHR
SCHEMBL9799583 0.76 PARP1 (0.44) HSD17B10GAAALDH1A1ALOX15TSHR
SCHEMBL9799587 0.76 PARP1 (0.44) HSD17B10GAAALDH1A1ALOX15TSHR
SCHEMBL24683843 0.75 GAA (0.50) HSD17B10GAAALDH1A1ALOX15TSHR
SCHEMBL29824637 0.75 GAA (0.50) HSD17B10GAAALDH1A1ALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5041663-A Plant safening agents CIBA-GEIGY CORPORATION (US) 1991-08-20 US disclosed
US-5032169-A Antidotes for herbicides CIBA-GEIGY CORPORATION (US) 1991-07-16 US disclosed
US-4759789-A Treating locus of plant before or during application of herbicide with oxime ether compound CIBA-GEIGY CORPORATION (US) 1988-07-26 US disclosed
US-4707182-A Phenoxine-ketal ethers, compositions containing them and the use thereof CIBA-GEIGY CORPORATION (US) 1987-11-17 US disclosed
US-4576628-A PLANT SAFENING AGENTS CIBA-GEIGY CORPORATION (US) 1986-03-18 US disclosed
US-4566901-A PLANT SAFENING AGENTS CIBA-GEIGY CORPORATION (US) 1986-01-28 US disclosed
US-4530716-A Plant safening agent CIBA-GEIGY CORPORATION (US) 1985-07-23 US disclosed