SCHEMBL29367490

SCHEMBL29367490

CC/C=C\CCCC(=O)O.CC/C=C\CCCC(=O)O

nearest known ligand 0.88

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.88
ALDH1A1 P00352 6/20 0.88
CYP19A1 P11511 6/20 0.88
F7 P08709 5/20 0.88
F3 P13726 5/20 0.88
PPARD Q03181 5/20 0.88
PPARA Q07869 5/20 0.88
KMT2A Q03164 4/20 0.88
OXER1 Q8TDS5 3/20 0.88
PTGS1 P23219 3/20 0.88
RXRA P19793 2/20 0.88
ADORA3 P0DMS8 2/20 0.88
MAPT P10636 6/20 0.74
BLM P54132 4/20 0.74
HSD17B10 Q99714 4/20 0.74
LMNA P02545 3/20 0.74
ALOX15 P16050 3/20 0.74
RECQL P46063 3/20 0.74
FFAR1 O14842 2/20 0.74
KDM4E B2RXH2 2/20 0.74

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
SCHEMBL583941 1.00 PPARG (0.88) PPARGALDH1A1CYP19A1F7F3
SCHEMBL583942 1.00 PPARG (0.88) PPARGALDH1A1CYP19A1F7F3
SCHEMBL583940 1.00 PPARG (0.88) PPARGALDH1A1CYP19A1F7F3
SCHEMBL23698075 0.98 PPARG (0.84) PPARGALDH1A1CYP19A1F7F3
SCHEMBL31607418 0.98 PPARG (0.84) PPARGALDH1A1CYP19A1F7F3
SCHEMBL23698073 0.98 PPARG (0.84) PPARGALDH1A1CYP19A1F7F3
SCHEMBL31607461 0.98 PPARG (0.84) PPARGALDH1A1CYP19A1F7F3
Acetic Acid SCHEMBL31277509 0.96 PPARG (0.81) PPARGALDH1A1CYP19A1F7F3
Acetic Acid SCHEMBL28235694 0.96 PPARG (0.81) PPARGALDH1A1CYP19A1F7F3
SCHEMBL23698170 0.94 PPARG (0.79) PPARGALDH1A1CYP19A1F7F3

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
CN-114002421-B Application of exosome metabolite as bipolar affective disorder marker 佛山市第三人民医院(佛山市精神卫生中心) 2022-04-05 CN disclosed
CN-114002421-A Application of exosome metabolite as bipolar affective disorder marker 佛山市第三人民医院(佛山市精神卫生中心) 2022-02-01 CN disclosed