SCHEMBL11207116

SCHEMBL11207116

COC(=O)C(F)(F)C(F)(F)CO

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KDM4E B2RXH2 1/20 0.31
PKM P14618 1/20 0.31
GAA P10253 1/20 0.31
TSHR P16473 1/20 0.31
KCNN4 O15554 1/20 0.30
CTRB1 P17538 1/20 0.30

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
SCHEMBL10520756 0.86 ALDH1A1 (0.32) DGAT1ALDH1A1
SCHEMBL1931458 0.80
SCHEMBL23882165 0.79 ALDH1A1 (0.32) DGAT1ALDH1A1GAA
SCHEMBL517250 0.79 ALDH1A1 (0.45) DGAT1ALDH1A1GAATSHRKCNN4
SCHEMBL815783 0.76 ALDH1A1 (0.34) DGAT1ALDH1A1GAA
SCHEMBL9418923 0.75 DGAT1 (0.36) DGAT1ALDH1A1KDM4EPKMGAA
SCHEMBL3608850 0.75
SCHEMBL517272 0.74 DGAT1 (0.39) DGAT1ALDH1A1GAATSHRKCNN4
SCHEMBL1129794 0.74 ALDH1A1 (0.42) DGAT1ALDH1A1GAAKCNN4
SCHEMBL497763 0.74 DGAT1 (0.39) DGAT1ALDH1A1GAATSHRKCNN4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0096130-A1 Process for the epoxidation of olefins EXXON RESEARCH AND ENGINEERING COMPANY (US) 1983-12-21 EP disclosed