SCHEMBL5113740

SCHEMBL5113740

COC(=O)C(C)Oc1cccc(-c2ccc(OCCN3CCOc4ccccc43)cc2)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
FFAR4 Q5NUL3 3/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYSLTR2 Q9NS75 1/20 0.38
CYSLTR1 Q9Y271 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
HTR7 P34969 1/20 0.38
KMT2A Q03164 1/20 0.38
GRM5 P41594 1/20 0.38
HTR1A P08908 1/20 0.38
SLC6A4 P31645 1/20 0.38
LTA4H P09960 1/20 0.38
KLK7 P49862 1/20 0.38
FFAR1 O14842 2/20 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
SCHEMBL5113265 0.84 TSHR (0.42) TSHRLMNAMAPTRXFP1CYSLTR2
SCHEMBL27576342 0.84 TSHR (0.43) TSHRLMNAMAPTRXFP1FFAR4
SCHEMBL5104269 0.82 PPARG (0.45) TSHRLMNAMAPTRXFP1FFAR4
SCHEMBL5114276 0.82 MAPT (0.47) LMNAMAPTRXFP1FFAR4PPARG
SCHEMBL5100773 0.82 PPARG (0.41) TSHRLMNAMAPTRXFP1FFAR4
SCHEMBL5101275 0.81 LMNA (0.41) TSHRLMNAMAPTRXFP1CYSLTR2
SCHEMBL27576348 0.81 HRH3 (0.41) TSHRFFAR4PPARGLTA4HFFAR1
SCHEMBL5113340 0.78 PPARG (0.49) TSHRLMNAMAPTRXFP1CYSLTR2
SCHEMBL5107151 0.76 PPARG (0.57) TSHRLMNAMAPTRXFP1PPARG
SCHEMBL5101223 0.76 TSHR (0.39) TSHRLMNAMAPTRXFP1CYSLTR2

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
CN-1353699-A Substituted bicyclic heterocycles, process for their preparation and their use as antiobesity and hypocholesterolemic agents REDDY RESEARCH FOUNDATION (IN) 2002-06-12 CN claimed
US-7348426-B1 Substituted bicyclic heterocycles, process for their preparation and their use as antiobesity and hypocholesterolemic agents DR. REDDY'S LABORATIES LIMITED (IN) 2008-03-25 US disclosed
CN-1353699-A Substituted bicyclic heterocycles, process for their preparation and their use as antiobesity and hypocholesterolemic agents REDDY RESEARCH FOUNDATION (IN) 2002-06-12 CN disclosed