SCHEMBL10299597

SCHEMBL10299597

COC(OC)(C(=O)c1ccc(OCCCCC(=O)O)cc1)c1ccc(OCCCCC(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 4/20 0.56
▸ CES1 P23141 1/20 0.51
▸ L3MBTL1 Q9Y468 3/20 0.46
▸ GAA P10253 2/20 0.45
▸ PLA2G4B P0C869 4/20 0.45
▸ TP53 P04637 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ PDE4B Q07343 1/20 0.44
▸ ALB P02768 1/20 0.44
▸ SERPINE1 P05121 1/20 0.43
▸ FFAR1 O14842 1/20 0.43
▸ PPARG P37231 1/20 0.43
▸ PPARD Q03181 1/20 0.43

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
SCHEMBL10299602 0.91 CES1 (0.61) PPARACES1SERPINE1FFAR1
SCHEMBL12114023 0.86 CES1 (0.63) PPARACES1L3MBTL1GAAFFAR1
SCHEMBL10299610 0.86 CES1 (0.63) PPARACES1L3MBTL1GAAFFAR1
SCHEMBL278824 0.85 CES1 (0.69) PPARACES1L3MBTL1GAAPLA2G4B
SCHEMBL10299599 0.83 SMN1; SMN2 (0.59) CES1TSHRFFAR1
SCHEMBL6463051 0.83 CES1 (0.53) CES1L3MBTL1GAA
SCHEMBL14045260 0.83 CES1 (0.61) PPARACES1L3MBTL1GAAPLA2G4B
SCHEMBL12116835 0.80 CES1 (0.61) PPARACES1L3MBTL1GAAPLA2G4B
SCHEMBL14020431 0.80 CES1 (0.65) PPARACES1L3MBTL1GAA
SCHEMBL16788943 0.80 SMN1; SMN2 (0.55) CES1L3MBTL1GAAPLA2G4BPPARD

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-8216353-B2 Photoinitiator is a benzyl ketal compound incorporating a pendent water-soluble group via an oxygen atom or a sulfur atom; exhibits a high photocuring sensitivity, specifically even to black ink, and is easily handled KONICA MINOLTA HOLDINGS, INC. (JP) 2012-07-10 — — US disclosed
US-20080241424-A1 Ink-jet ink and ink-jet recording method KONICA MINOLTA HOLDINGS, INC. (JP) 2008-10-02 — — US disclosed
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