SCHEMBL10977611

SCHEMBL10977611

O=C(F)c1c(F)cc(F)c(OC(F)(F)F)c1F

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.35
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA4 P22748 2/20 0.34
FFAR1 O14842 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32

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
SCHEMBL10974680 0.84 EPHX2 (0.34) EPHX2CA1CA2CA4FFAR1
SCHEMBL6725139 0.75 FFAR1 (0.33) EPHX2FFAR1FFAR4
SCHEMBL6728940 0.75 AKR1C2 (0.37) EPHX2FFAR1FFAR4
SCHEMBL9804225 0.73 EPHX2 (0.32) EPHX2
SCHEMBL5522939 0.73 EPHX2 (0.36) EPHX2CA1CA2CA4FFAR1
SCHEMBL9693376 0.72 CA1 (0.50) CA1CA2CA4
SCHEMBL10980769 0.71 CES2 (0.31)
SCHEMBL22884508 0.69 TUBB1 (0.31)
SCHEMBL17553290 0.69 GPR3 (0.32) EPHX2CA1CA2CA4
SCHEMBL11032174 0.69 PDE2A (0.30) FFAR1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0075146-B1 BENZYL ESTERS WITH FLUOROSUBSTITUTED ETHER GROUPS, PROCESS FOR THEIR PREPARATION AND THEIR UTILISATION AS INSECTICIDES BAYER AG (DE) 1985-10-23 EP disclosed
EP-0075146-A1 Benzyl esters with fluorosubstituted ether groups, process for their preparation and their utilisation as insecticides BAYER AG (DE) 1983-03-30 EP disclosed