SCHEMBL4756342

SCHEMBL4756342

CCOC(=O)[C@H](O)Cc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.65
LMNA P02545 1/20 0.65
PPARA Q07869 4/20 0.60
PPARG P37231 3/20 0.60
LTA4H P09960 2/20 0.60
PPARD Q03181 1/20 0.60
LAP3 P28838 1/20 0.59
ALOX5 P09917 3/20 0.57
NR1H4 Q96RI1 1/20 0.55
ALDH1A1 P00352 1/20 0.55
FFAR1 O14842 1/20 0.55
FFAR4 Q5NUL3 1/20 0.55
MAOB P27338 3/20 0.54
NR4A1 P22736 1/20 0.51
NR4A2 P43354 1/20 0.51
NR4A3 Q92570 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
SCHEMBL5375675 1.00 L3MBTL1 (0.65) L3MBTL1LMNAPPARAPPARGLTA4H
SCHEMBL1596779 1.00 L3MBTL1 (0.65) L3MBTL1LMNAPPARAPPARGLTA4H
SCHEMBL27854776 0.90 LTA4H (0.71) LMNAPPARAPPARGLTA4HPPARD
SCHEMBL6738407 0.89 LTA4H (0.57) L3MBTL1LMNAPPARAPPARGLTA4H
SCHEMBL6738411 0.89 LTA4H (0.57) L3MBTL1LMNAPPARAPPARGLTA4H
SCHEMBL4755605 0.89 L3MBTL1 (0.52) L3MBTL1LMNAPPARAPPARGLTA4H
SCHEMBL2164928 0.87 LTA4H (0.72) PPARAPPARGLTA4HPPARDLAP3
SCHEMBL6732617 0.87 LTA4H (0.72) PPARAPPARGLTA4HPPARDLAP3
SCHEMBL9493387 0.87 L3MBTL1 (0.67) L3MBTL1LMNAPPARAPPARGLTA4H
SCHEMBL5309375 0.87 LTA4H (0.72) PPARAPPARGLTA4HPPARDLAP3

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
WO-2008010238-A2 ANTIDIABETIC AZABICYCLO [3. 1. 0] HEXAN COMPOUNDS LUPIN LIMITED (IN) 2008-01-24 WO disclosed