SCHEMBL9827993

SCHEMBL9827993

CC(Oc1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1/C=N/Oc1ccccc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.48
MEN1 O00255 1/20 0.43
TTR P02766 1/20 0.43
PPOX P50336 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PTGDR2 Q9Y5Y4 4/20 0.42
STK39 Q9UEW8 1/20 0.38
PPARG P37231 1/20 0.38
ABCB11 O95342 1/20 0.38
MRGPRX4 Q96LA9 2/20 0.38
HTR2A P28223 1/20 0.38
SLC6A4 P31645 1/20 0.38
KCNH2 Q12809 1/20 0.38
EGFR P00533 3/20 0.37
ERBB2 P04626 3/20 0.37

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
SCHEMBL9827997 1.00 FFAR1 (0.48) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9826732 0.86 FFAR1 (0.54) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9827878 0.83 FFAR1 (0.45) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9827873 0.83 FFAR1 (0.45) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11186418 0.82 FFAR1 (0.60) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9826979 0.82 FFAR1 (0.43) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9826985 0.82 FFAR1 (0.43) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9827869 0.81 FFAR1 (0.45) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9827861 0.81 FFAR1 (0.45) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9827984 0.81 FFAR1 (0.46) 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 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