SCHEMBL8360485

SCHEMBL8360485

CCCCCCCCCCCCCCCCCC(=O)OCCCC.O=C(O)CCCCCCCCCCCCCCCC1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.51
NAAA Q02083 3/20 0.50
EPHX2 P34913 1/20 0.48
KDM5A P29375 3/20 0.48
PHF8 Q9UPP1 3/20 0.48
KDM2A Q9Y2K7 3/20 0.48
KDM4C Q9H3R0 2/20 0.48
KDM4A O75164 1/20 0.48
PAM P19021 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 1/20 0.46
ALOX5 P09917 1/20 0.46
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.45
SLC22A6 Q4U2R8 1/20 0.45
SLC22A8 Q8TCC7 1/20 0.45
GPR84 Q9NQS5 1/20 0.45
PPARG P37231 1/20 0.45
PPARD Q03181 1/20 0.45
PPARA Q07869 1/20 0.45

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
SCHEMBL1516540 0.92 DGKA (0.57) DGKANAAAEPHX2SMN1; SMN2
SCHEMBL38658793 0.90 KDM5A (0.54) NAAAKDM5APHF8KDM2AKDM4C
SCHEMBL5709875 0.88 EPHX2 (0.56) DGKANAAAEPHX2SMN1; SMN2
Adipic Acid SCHEMBL31307076 0.87 KDM5A (0.59) KDM5APHF8KDM2AKDM4CKDM4A
SCHEMBL5710039 0.86 DGKA (0.61) DGKANAAAEPHX2PAMSMN1; SMN2
SCHEMBL11851395 0.86 DGKA (0.59) DGKANAAAEPHX2PAMALDH1A1
SCHEMBL11859182 0.86 DGKA (0.59) DGKANAAAEPHX2PAMALDH1A1
SCHEMBL11858057 0.86 DGKA (0.59) DGKANAAAEPHX2PAMALDH1A1
SCHEMBL11851677 0.86 DGKA (0.59) DGKANAAAEPHX2PAMALDH1A1
SCHEMBL6523279 0.85 DGKA (0.49) DGKANAAAEPHX2SMN1; SMN2

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-5879438-A CONTAINING SPECIFIC ELECTRON ACCEPTING LIGHTFASTNESS PROVIDING AGENT THE PILOT INK CO., LTD. (JP) 1999-03-09 US disclosed
US-5873932-A BLENDING AN ELECTRON DONATING COMPOUND, AN ELECTRON ACCEPTING COMPOUND, A METACHROMATIC TEMPERATURE ADJUSTER, AN ELECTRON ACCEPTING, LIGHT-FASTNESS PROVIDING AGENT THE PILOT INK CO., LTD. (JP) 1999-02-23 US disclosed