SCHEMBL9827043

SCHEMBL9827043

CCOC(=O)COc1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1C=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.47
ALDH1A1 P00352 3/20 0.45
HPGD P15428 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
LMNA P02545 2/20 0.45
MAPT P10636 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
NTSR1 P30989 1/20 0.45
CYP2C19 P33261 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
TTR P02766 1/20 0.44
PPOX P50336 1/20 0.44
MRGPRX4 Q96LA9 2/20 0.43
PPARD Q03181 2/20 0.43
PPARA Q07869 2/20 0.43
EGFR P00533 1/20 0.43

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
SCHEMBL9828392 0.90 FFAR1 (0.48) FFAR1ALDH1A1LMNAMAPTMEN1
SCHEMBL9827058 0.88 FFAR1 (0.48) FFAR1LMNAMAPTCYP1A2CYP2C9
SCHEMBL10614620 0.85 FFAR1 (0.57) FFAR1NPSR1LMNAMAPTMEN1
SCHEMBL9827286 0.83 FFAR1 (0.48) FFAR1MEN1KMT2ATDP1TTR
SCHEMBL5320603 0.83 MRGPRX4 (0.57) ALDH1A1CYP2C19TDP1MRGPRX4PPARD
SCHEMBL9572398 0.83 MRGPRX4 (0.52) FFAR1MEN1KMT2ATDP1TTR
SCHEMBL10837253 0.80 GAA (0.45) FFAR1ALDH1A1NPSR1MEN1KMT2A
SCHEMBL10999187 0.80 GAA (0.45) FFAR1ALDH1A1NPSR1MEN1KMT2A
SCHEMBL10994996 0.79 NPSR1 (0.44) FFAR1ALDH1A1NPSR1MEN1KMT2A
SCHEMBL10836460 0.79 GAA (0.44) FFAR1ALDH1A1NPSR1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0442172-A1 Oxime derivatives and Herbicides containing the same as an active ingredient TEIJIN LIMITED (JP) 1991-08-21 EP disclosed
EP-0433451-A1 OXIME DERIVATIVES AND HERBICIDES CONTAINING THE SAME AS AN ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1991-06-26 EP disclosed
WO-1990001874-A1 OXIME DERIVATIVES AND HERBICIDES CONTAINING THE SAME AS AN ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1990-03-08 WO disclosed