SCHEMBL13870514

SCHEMBL13870514

CCCCCCCCCCCCCCCCCCNC(=O)NCCCCC(NC(=O)NCCCCCCCCCCCCCCCCCC)C(=O)OC

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 9/20 0.58
▸ SIRT1 Q96EB6 2/20 0.50
▸ SIRT2 Q8IXJ6 1/20 0.50
▸ SIRT3 Q9NTG7 1/20 0.50
▸ ZDHHC7 Q9NXF8 1/20 0.49
▸ MAPT P10636 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ SIRT6 Q8N6T7 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ POLB P06746 1/20 0.47
▸ FOLH1 Q04609 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.45
▸ TSHR P16473 1/20 0.44

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
SCHEMBL12193060 1.00 EPHX1 (0.58) EPHX1SIRT1SIRT2SIRT3ZDHHC7
SCHEMBL12193073 0.97 EPHX1 (0.58) EPHX1SIRT1SIRT2SIRT3ZDHHC7
SCHEMBL12216844 0.92 EPHX1 (0.58) EPHX1SIRT1SIRT2SIRT3ZDHHC7
SCHEMBL12193087 0.91 ACHE (0.49) EPHX1SIRT1SIRT2SIRT3
SCHEMBL13870509 0.90 SIRT2 (0.51) EPHX1SIRT1SIRT2SIRT3
SCHEMBL8081681 0.90 SIRT2 (0.51) EPHX1SIRT1SIRT2SIRT3
SCHEMBL14097276 0.90 EPHX1 (0.50) EPHX1SIRT1SIRT2SIRT3ZDHHC7
SCHEMBL12193061 0.90 EPHX1 (0.56) EPHX1SIRT1SIRT6SMN1; SMN2FOLH1
SCHEMBL2496993 0.86 EPHX1 (0.58) EPHX1MAPTHSD17B10SMN1; SMN2POLB
SCHEMBL12193134 0.85 EPHX2 (0.51) EPHX1SIRT1SIRT2SIRT3POLB

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
US-7517566-B2 Liquid crystal composition containing at least two gelling agents showing a liquid crystal phase at room temperature, one of which is self-organizing and has an intermolecular binding group-containing unit and a saturated aliphatic hydrocarbon group; improved in whiteness and brightness KONICA MINOLTA HOLDINGS, INC. (JP) 2009-04-14 — — US disclosed
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