SCHEMBL5486159

SCHEMBL5486159

COc1ccc(CN(c2nc3cc(S(=O)(=O)N(C)C)ccc3o2)C2CCNCC2)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 4/20 0.49
ALDH1A1 P00352 4/20 0.47
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
HDAC6 Q9UBN7 1/20 0.42
PKM P14618 1/20 0.41
HTT P42858 1/20 0.40
LMNA P02545 4/20 0.40
KCNH2 Q12809 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HRH1 P35367 2/20 0.39
HSD17B10 Q99714 2/20 0.39
USP2 O75604 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
HIF1A Q16665 5/20 0.38
EPAS1 Q99814 4/20 0.38
EP300 Q09472 1/20 0.38

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
SCHEMBL5485488 0.94 SSTR5 (0.57) SSTR5ALDH1A1CRHBPCRHR2HDAC6
SCHEMBL5487219 0.93 SSTR5 (0.51) SSTR5ALDH1A1CRHBPCRHR2HDAC6
SCHEMBL5483683 0.93 SSTR5 (0.49) SSTR5ALDH1A1CRHBPCRHR2HDAC6
SCHEMBL5481883 0.91 SSTR5 (0.43) SSTR5ALDH1A1CRHBPCRHR2HDAC6
SCHEMBL5486209 0.87 SSTR5 (0.47) SSTR5ALDH1A1CRHBPCRHR2HTT
SCHEMBL5479667 0.86 SSTR5 (0.47) SSTR5ALDH1A1HTTLMNAKCNH2
SCHEMBL5489244 0.86 SSTR5 (0.47) SSTR5ALDH1A1HTTLMNAKCNH2
SCHEMBL5478929 0.86 SSTR5 (0.48) SSTR5ALDH1A1CRHBPCRHR2HTT
SCHEMBL1379151 0.85 SSTR5 (0.56) SSTR5ALDH1A1HDAC6KCNH2MEN1
SCHEMBL4944644 0.85 SSTR5 (0.41) SSTR5ALDH1A1CRHBPCRHR2HTT

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-1858901-A1 BENZOTHIAZOLE, THIAZOLOPYRIDINE, BENZOOXAZOLE AND OXAZOLOPYRIDINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2007-11-28 EP disclosed
WO-2006094682-A1 BENZOTHIAZOLE, THIAZOLOPYRIDINE, BENZOOXAZOLE AND OXAZOLOPYRIDINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2006-09-14 WO disclosed