SCHEMBL5495576

SCHEMBL5495576

[CH2]CCCCCCCCC[CH]C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
HCAR2 Q8TDS4 2/20 0.37
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
TSHR P16473 2/20 0.30
CYP3A4 P08684 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
SCHEMBL2260913 0.91
SCHEMBL183392 0.82
SCHEMBL2018468 0.81 EPHX1 (0.45) LMNATSHRCYP3A4
SCHEMBL2167450 0.81 EPHX1 (0.45) LMNATSHRCYP3A4
SCHEMBL8744318 0.81 EPHX1 (0.45) LMNATSHRCYP3A4
SCHEMBL8744392 0.81 EPHX1 (0.45) LMNATSHRCYP3A4
SCHEMBL8544644 0.81 EPHX1 (0.45) LMNATSHRCYP3A4
SCHEMBL8744391 0.81 EPHX1 (0.45) LMNATSHRCYP3A4
SCHEMBL5078165 0.81 EPHX1 (0.45) LMNATSHRCYP3A4
SCHEMBL16288472 0.80 HCAR2 (0.44) ALDH1A1LMNAHCAR2KEAP1NFE2L2

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
US-20070149755-A1 Thermosetting powder coating composition DAINIPPON INK AND CHEMICALS INC. (JP) 2007-06-28 US disclosed
EP-1698675-A1 THERMOSETTING POWDER COATING COMPOSITION Dainippon Ink and Chemicals, Incorporated (JP) 2006-09-06 EP disclosed