SCHEMBL2854523

SCHEMBL2854523

CCCCCCCNC(=O)N(C)c1cccc(-c2ccc(C[C@](CC(CC)CCCC)(Nc3ccccc3C(=O)c3ccccc3)C(=O)O)cc2)c1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 2/20 0.34
PTGS2 P35354 1/20 0.33
PTPN1 P18031 1/20 0.33
PPARG P37231 2/20 0.32
NAAA Q02083 1/20 0.31
ALOX15 P16050 2/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP8 P22894 1/20 0.31
MMP12 P39900 1/20 0.31
MMP14 P50281 1/20 0.31
PPARA Q07869 1/20 0.31
SIRT2 Q8IXJ6 1/20 0.30
SIRT1 Q96EB6 1/20 0.30
SIRT3 Q9NTG7 1/20 0.30

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
SCHEMBL2855300 0.91 LTB4R2 (0.38) LTB4R2PTGS2PTPN1PPARGNAAA
SCHEMBL2847841 0.90 LTB4R2 (0.38) LTB4R2PTGS2PTPN1PPARGNAAA
SCHEMBL2849456 0.89 LTB4R2 (0.37) LTB4R2PTGS2PTPN1PPARGNAAA
SCHEMBL2854102 0.89 LTB4R2 (0.37) LTB4R2PTGS2PTPN1PPARGNAAA
SCHEMBL2849758 0.87 LTB4R2 (0.36) LTB4R2PTGS2PTPN1PPARGNAAA
SCHEMBL2859541 0.87 LTB4R2 (0.36) LTB4R2PTGS2PTPN1PPARGNAAA
SCHEMBL2858449 0.85 ROCK2 (0.38) PTGS2HDAC1
SCHEMBL2851855 0.83 TACR2 (0.38) ALOX15SIRT2SIRT1
SCHEMBL2854521 0.81 PPARG (0.41) PPARGPPARA
SCHEMBL2852386 0.81 PPARG (0.45) PPARGPPARA

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
EP-1575911-B1 BIAROMATIC COMPOUNDS WHICH ACTIVATE PPAR-GAMMA TYPE RECEPTORS AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RES & DEV (FR) 2010-01-13 EP claimed