SCHEMBL6955185

SCHEMBL6955185

CCOC(=O)C(Cc1ccc(OCCN2COc3ccccc3C2=O)cc1)(OCC)C(=O)NC

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 7/20 0.37
PPARA Q07869 4/20 0.35
PPARG P37231 3/20 0.35
HPGD P15428 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL6950918 0.86 PPARG (0.36) LTA4HPPARAPPARGHPGDNPSR1
SCHEMBL6949965 0.86 PPARA (0.35) LTA4HPPARAPPARGHPGDNPSR1
SCHEMBL6948917 0.77 PPARG (0.40) LTA4HPPARAPPARGHPGDNPSR1
SCHEMBL7248494 0.77 PPARG (0.52) PPARAPPARG
Hydrochloric Acid SCHEMBL6944979 0.77 PPARG (0.41) LTA4HPPARAPPARGHPGDNPSR1
SCHEMBL6956266 0.76 PPARA (0.34) LTA4HPPARAPPARGHPGDNPSR1
SCHEMBL6949189 0.75 MAPK1 (0.57) HPGDNPSR1ALDH1A1POLBMAPT
SCHEMBL6948171 0.75 TNF (0.48) PPARAPPARGALDH1A1POLBMAPT
SCHEMBL6955034 0.74 NPC1 (0.54) LTA4HPPARAHPGDALDH1A1POLB
SCHEMBL7248373 0.74 PPARG (0.62) PPARAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0903343-B1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP CO LTD (JP) 2003-05-28 EP disclosed
EP-0903343-A1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP Co., Ltd. (JP) 1999-03-24 EP disclosed