SCHEMBL9507497

SCHEMBL9507497

COC(=O)C(C)Oc1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1C(C)=O

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.48
MEN1 O00255 1/20 0.48
TTR P02766 1/20 0.48
PPOX P50336 1/20 0.48
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
HTR2A P28223 1/20 0.43
SLC6A4 P31645 1/20 0.43
KCNH2 Q12809 1/20 0.43
SCN8A Q9UQD0 1/20 0.43
SCN10A Q9Y5Y9 1/20 0.43
STK39 Q9UEW8 1/20 0.41
MAPT P10636 3/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.40

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
SCHEMBL9507539 0.92 FFAR1 (0.48) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9507544 0.92 MEN1 (0.55) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9507156 0.90 FFAR1 (0.49) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11442480 0.89 FFAR1 (0.52) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11258317 0.89 FFAR1 (0.54) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9503643 0.89 FFAR1 (0.46) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9507500 0.88 FFAR1 (0.45) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9503642 0.88 FFAR1 (0.48) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9505794 0.88 FFAR1 (0.48) FFAR1TDP1SCN8ASCN10ASTK39
SCHEMBL11436042 0.87 FFAR1 (0.49) FFAR1MEN1TTRPPOXKMT2A

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
EP-0281103-B1 PHENOXYCARBOXYLIC ACID COMPOUNDS AND HERBICIDE COMPRISING IT AS ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1993-06-23 EP disclosed
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
US-4845264-A PRE- AND POST-EMERGENCE FOR BROAD-LEAVED WEEDS TEIJIN LIMITED (JP) 1989-07-04 US disclosed
EP-0281103-A2 Phenoxycarboxylic acid compounds and herbicide comprising it as active ingredient TEIJIN LIMITED (JP) 1988-09-07 EP disclosed