SCHEMBL6992531

SCHEMBL6992531

CCOS(=O)(=O)c1ccc(C)cc1-c1nc(-c2cccs2)oc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPT P10636 12/20 0.41
TP53 P04637 5/20 0.40
THRB P10828 2/20 0.40
POLB P06746 3/20 0.39
VDR P11473 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
HSD17B10 Q99714 2/20 0.38
PPARG P37231 2/20 0.38
USP2 O75604 1/20 0.38
NCOA2 Q15596 1/20 0.38
NCOA1 Q15788 1/20 0.38
HPGD P15428 2/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 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
SCHEMBL634168 0.83 TARBP2 (0.42) ALDH1A1KDM4EMAPTTP53POLB
SCHEMBL27559786 0.82 ALDH1A1 (0.42) ALDH1A1KDM4EMAPTTP53POLB
SCHEMBL6994309 0.82 MAPT (0.41) ALDH1A1KDM4EMAPTTP53THRB
SCHEMBL6990599 0.73 FLT1 (0.38) ALDH1A1KDM4EMAPTTP53THRB
SCHEMBL6991142 0.72 KDM4E (0.37) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL4021097 0.70 EDNRA (0.44) ALDH1A1KDM4EMAPTTP53POLB
SCHEMBL9411853 0.69 MAPT (0.41) ALDH1A1MAPTTP53POLBKMT2A
SCHEMBL4898554 0.67 MAPT (0.50) ALDH1A1KDM4EMAPTTP53THRB
SCHEMBL23174731 0.67 CCR1 (0.39) ALDH1A1KDM4EMAPTTP53THRB
SCHEMBL23174762 0.67 ALPL (0.36) ALDH1A1MAPTPOLBMEN1KMT2A

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-1313716-A1 OXAZOLYL-ARYLPROPIONIC ACID DERIVATIVES AND THEIR USE AS PPAR AGONISTS ELI LILLY AND COMPANY (US) 2003-05-28 EP disclosed
WO-2002016331-A1 OXAZOLYL-ARYLPROPIONIC ACID DERIVATIVES AND THEIR USE AS PPAR AGONISTS ELI LILLY AND COMPANY (US) 2002-02-28 WO disclosed