SCHEMBL9799631

SCHEMBL9799631

C=CCON=C(c1ccc(Cl)cc1)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.34
GAA P10253 4/20 0.33
LMNA P02545 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPT P10636 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL9799526 0.77 PSEN1 (0.40) SMN1; SMN2GAALMNAALDH1A1ALOX15
SCHEMBL9799744 0.76 ALDH1A1 (0.38) SMN1; SMN2GAALMNAALDH1A1HPGD
SCHEMBL9799924 0.75 L3MBTL1 (0.43) SMN1; SMN2GAALMNAALDH1A1HPGD
SCHEMBL11040229 0.75 L3MBTL1 (0.43) SMN1; SMN2GAALMNAALDH1A1HPGD
SCHEMBL10742966 0.74 GAA (0.34) GAALMNAALDH1A1HPGDMEN1
SCHEMBL5933972 0.72 NPC1 (0.33) SMN1; SMN2GAALMNAALDH1A1NPC1
SCHEMBL175984 0.72 NPC1 (0.33) SMN1; SMN2GAALMNAALDH1A1NPC1
SCHEMBL10668466 0.72 MAPT (0.35) SMN1; SMN2LMNAALDH1A1HPGDTSHR
SCHEMBL10744552 0.71 GAA (0.33) SMN1; SMN2GAALMNAALDH1A1ALOX15
SCHEMBL17720583 0.71 CES2 (0.38) SMN1; SMN2GAALMNAALDH1A1KMT2A

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 6 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 claimed
EP-0094348-B1 OXIME ETHERS, PROCESS FOR THEIR PREPARATION, AGENTS CONTAINING THE OXIME ETHERS AND THEIR USE CIBA-GEIGY AG (CH) 1985-07-24 EP claimed
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-4566901-A PLANT SAFENING AGENTS CIBA-GEIGY CORPORATION (US) 1986-01-28 US disclosed