SCHEMBL5264764

SCHEMBL5264764

CCCCCCCNC(=O)N(C)c1cc(-c2ccccc2)ccc1C[C@H](OCc1ccccc1)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.41
MMP2 P08253 2/20 0.40
MMP9 P14780 2/20 0.40
MMP8 P22894 2/20 0.40
MMP12 P39900 2/20 0.40
MMP14 P50281 2/20 0.40
SIRT2 Q8IXJ6 5/20 0.40
SIRT1 Q96EB6 3/20 0.40
HPGD P15428 2/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
SIRT3 Q9NTG7 2/20 0.39
PPARA Q07869 4/20 0.38
PPARG P37231 3/20 0.38
ITGB3 P05106 1/20 0.38
ITGAV P06756 1/20 0.38
PLG P00747 1/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37

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
SCHEMBL6252730 1.00 PTGS2 (0.41) PTGS2MMP2MMP9MMP8MMP12
SCHEMBL5266960 0.99 PTGS2 (0.40) PTGS2MMP2MMP9MMP8MMP12
SCHEMBL5267215 0.92 PTGS2 (0.43) PTGS2MMP2MMP9MMP8MMP12
SCHEMBL6255401 0.91 PTGS2 (0.42) PTGS2MMP2MMP9MMP8MMP12
SCHEMBL5267461 0.91 PTGS2 (0.42) PTGS2MMP2MMP9MMP8MMP12
SCHEMBL5268750 0.91 PTGS2 (0.42) PTGS2MMP2MMP9MMP8MMP12
SCHEMBL5266056 0.91 PTGS2 (0.41) PTGS2MMP2MMP9MMP8MMP12
SCHEMBL5266959 0.91 PTGS2 (0.41) PTGS2MMP2MMP9MMP8MMP12
SCHEMBL5271286 0.88 PTGS2 (0.40) PTGS2MMP2MMP9MMP8MMP12
SCHEMBL5267743 0.87 PTGS2 (0.40) PTGS2MMP2MMP9MMP8MMP12

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-1742608-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE PPARϝ-TYPE RECEPTORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2007-01-17 EP claimed
WO-2005108352-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE PPARϜ-TYPE RECEPTORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-11-17 WO claimed
EP-1742608-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE PPARϝ-TYPE RECEPTORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2007-01-17 EP disclosed
WO-2005108352-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE PPARϜ-TYPE RECEPTORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-11-17 WO disclosed