SCHEMBL27478917

SCHEMBL27478917

CC(C)(C)OC(=O)C(Cc1ccc(OCc2ccccc2)cc1)C(=O)OCN

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.53
LAP3 P28838 1/20 0.51
PPARG P37231 3/20 0.48
PPARA Q07869 3/20 0.48
MAOB P27338 3/20 0.47
FFAR1 O14842 1/20 0.47
FFAR4 Q5NUL3 1/20 0.47
PPARD Q03181 1/20 0.46
YAP1 P46937 2/20 0.46
BCL2 P10415 1/20 0.46
PARP10 Q53GL7 1/20 0.45
ALOX5 P09917 1/20 0.45
PRKCA P17252 1/20 0.45
PRKCD Q05655 1/20 0.45

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
SCHEMBL27461095 0.89 LMNA (0.57) LTA4HLAP3PPARGPPARAMAOB
SCHEMBL3522497 0.89 PPARA (0.56) LTA4HLAP3PPARGPPARAMAOB
SCHEMBL3522492 0.89 PPARA (0.56) LTA4HLAP3PPARGPPARAMAOB
SCHEMBL28944664 0.84 EGFR (0.41) LTA4HFFAR4
SCHEMBL27804913 0.84 ITGA4 (0.41) LTA4HMAOBFFAR4
SCHEMBL7338836 0.83 LTA4H (0.65) LTA4HLAP3PPARGPPARAMAOB
SCHEMBL7339057 0.83 LTA4H (0.65) LTA4HLAP3PPARGPPARAMAOB
SCHEMBL7338844 0.83 LTA4H (0.65) LTA4HLAP3PPARGPPARAMAOB
SCHEMBL27478916 0.83 ITGA4 (0.48) LTA4H
SCHEMBL27514471 0.81 LTA4H (0.53) LTA4HLAP3PPARGPPARAMAOB

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
CN-1143647-A Dipeptides which promote release of growth hormone PFIZER (US) 1997-02-26 CN disclosed