SCHEMBL3405574

SCHEMBL3405574

CCCCOc1ccc(CCCc2ccc(CCC(=O)O)cc2OCCC)cc1OC

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.52
HDAC2 Q92769 2/20 0.52
LMNA P02545 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
PPARA Q07869 2/20 0.50
LTA4H P09960 1/20 0.49
LTB4R Q15722 1/20 0.48
FFAR4 Q5NUL3 1/20 0.48
KDM4E B2RXH2 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
APP P05067 1/20 0.47
PPARG P37231 1/20 0.46
RXRA P19793 1/20 0.46

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
SCHEMBL1270107 0.98 HDAC1 (0.53) HDAC1HDAC2LMNAL3MBTL1PPARA
SCHEMBL1270026 0.94 HDAC1 (0.51) HDAC1HDAC2PPARALTA4HLTB4R
SCHEMBL1269120 0.91 APP (0.61) HDAC1HDAC2FFAR4SMN1; SMN2APP
SCHEMBL1269393 0.90 HDAC1 (0.53) HDAC1HDAC2LTA4HKDM4ESMN1; SMN2
SCHEMBL1270374 0.89 CYP3A4 (0.58) LTA4HLTB4RRXRA
SCHEMBL1270236 0.89 HDAC1 (0.46) HDAC1HDAC2LMNAL3MBTL1PPARA
SCHEMBL1268950 0.89 LTA4H (0.47) HDAC1HDAC2PPARALTA4HLTB4R
SCHEMBL3693650 0.88 LMNA (0.60) HDAC1HDAC2LMNAL3MBTL1PPARA
SCHEMBL1270074 0.88 HDAC1 (0.55) HDAC1HDAC2LTA4HSMN1; SMN2APP
SCHEMBL1270202 0.87 HDAC1 (0.44) HDAC1HDAC2LMNAL3MBTL1PPARA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2155662-B1 NOVEL DERIVATIVES OF 3-PHENYL PROPANOIC ACID ACTIVATING PPAR-TYPE RECEPTORS, METHOD FOR PREPARING SAME AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RES & DEV (FR) 2010-12-01 EP disclosed
EP-2155662-A2 NOVEL DERIVATIVES OF 3-PHENYL PROPANOIC ACID ACTIVATING PPAR-TYPE RECEPTORS, METHOD FOR PREPARING SAME AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development (FR) 2010-02-24 EP disclosed
WO-2008152333-A9 NOVEL DERIVATIVES OF 3-PHENYL PROPANOIC ACID ACTIVATING PPAR-TYPE RECEPTORS, METHOD FOR PREPARING SAME AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT (FR) 2009-12-10 WO disclosed
WO-2008152333-A2 NOVEL DERIVATIVES OF 3-PHENYL PROPANOIC ACID ACTIVATING PPAR-TYPE RECEPTORS, METHOD FOR PREPARING SAME AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-12-18 WO disclosed