SCHEMBL6032489

SCHEMBL6032489

CN(Cc1cccc(-c2ccc(O)cc2)c1)C(=O)OC(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 4/20 0.57
HSD17B2 P37059 4/20 0.57
AOC3 Q16853 12/20 0.53
ABHD6 Q9BV23 2/20 0.53
MGLL Q99685 1/20 0.51

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
SCHEMBL6254244 0.86 AOC3 (0.50) HSD17B2AOC3ABHD6MGLL
SCHEMBL18664587 0.86 MTOR (0.44) HSD17B1HSD17B2
SCHEMBL16942777 0.85 HSD17B2 (0.53) HSD17B1HSD17B2
SCHEMBL2229917 0.82 MTOR (0.48)
SCHEMBL5374253 0.81 HSD17B1 (0.65) HSD17B1HSD17B2AOC3ABHD6
SCHEMBL11372012 0.80 AOC3 (0.82) AOC3
SCHEMBL6184972 0.80 ABHD6 (0.47) AOC3ABHD6MGLL
SCHEMBL30264842 0.80 HSP90AA1 (0.49) HSD17B1HSD17B2AOC3ABHD6MGLL
SCHEMBL1831339 0.80 GLS (0.50) AOC3ABHD6MGLL
SCHEMBL7021352 0.80 GLS (0.53) AOC3ABHD6MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7125869-B2 Polycyclic compounds which modulate PPARγ type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2006-10-24 US disclosed
EP-1572629-A1 COMPOUNDS WHICH MODULATE PPARϝ TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2005-09-14 EP disclosed
WO-2004052840-A1 COMPOUNDS WHICH MODULATE PPARϜ TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-06-24 WO disclosed