SCHEMBL4593346

SCHEMBL4593346

CCOc1cc(CN(c2nc3cccc(OCCCC(=O)O)c3o2)C2CCNCC2)cc(OCC)c1F

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.35
PPARD Q03181 2/20 0.35
PPARA Q07869 2/20 0.35
SSTR5 P35346 3/20 0.34
REN P00797 1/20 0.33
FFAR4 Q5NUL3 3/20 0.33
HTR2A P28223 2/20 0.33
KCNH2 Q12809 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
RAB9A P51151 1/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
SLC6A3 Q01959 2/20 0.33
PDE10A Q9Y233 2/20 0.32
NPC1L1 Q9UHC9 1/20 0.32

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
SCHEMBL4594594 0.92 SSTR5 (0.35) PPARGPPARDPPARASSTR5REN
SCHEMBL4594401 0.91 GLA (0.36) PPARGPPARDPPARASSTR5HTR2A
SCHEMBL4593591 0.89 REN (0.43) PPARASSTR5RENKCNH2MEN1
SCHEMBL4594833 0.87 SSTR5 (0.36) SSTR5HTR2AKCNH2MEN1KMT2A
SCHEMBL4594609 0.85 SSTR5 (0.38) PPARGPPARDPPARASSTR5FFAR4
SCHEMBL5486981 0.83 SSTR5 (0.37) SSTR5HTR2AKCNH2MEN1KMT2A
SCHEMBL4594411 0.83 REN (0.43) SSTR5RENKCNH2SLC6A2SLC6A4
SCHEMBL4594289 0.81 SSTR5 (0.39) SSTR5KCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL4593365 0.81 SSTR5 (0.36) SSTR5HTR2AKCNH2SLC6A2SLC6A4
SCHEMBL4593502 0.81 REN (0.39) SSTR5RENKCNH2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1924579-A2 BENZOOXAZOLE, OXAZOLOPYRIDINE, BENZOTHIAZOLE AND THIAZOLOPYRIDINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-05-28 EP claimed
WO-2007025897-A2 BENZOOXAZOLE, OXAZOLOPYRIDINE, BENZOTHIAZOLE AND THIAZOLOPYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-03-08 WO claimed
EP-1924579-A2 BENZOOXAZOLE, OXAZOLOPYRIDINE, BENZOTHIAZOLE AND THIAZOLOPYRIDINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-05-28 EP disclosed
WO-2007025897-A2 BENZOOXAZOLE, OXAZOLOPYRIDINE, BENZOTHIAZOLE AND THIAZOLOPYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-03-08 WO disclosed