SCHEMBL5482720

SCHEMBL5482720

O=C(O)c1cccc2nc(N(Cc3ccc(F)c(OCCF)c3)C3CCNCC3)oc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.36
SLC6A2 P23975 6/20 0.36
SLC6A3 Q01959 6/20 0.36
PPARG P37231 2/20 0.35
PPARD Q03181 2/20 0.35
PPARA Q07869 2/20 0.35
PDE10A Q9Y233 1/20 0.34
PIM1 P11309 2/20 0.33
PIM2 Q9P1W9 2/20 0.33
TACR1 P25103 3/20 0.33
DHODH Q02127 1/20 0.32
HTR1A P08908 1/20 0.32
ADRA2A P08913 1/20 0.32
DRD2 P14416 1/20 0.32
ADRA2C P18825 1/20 0.32
DRD1 P21728 1/20 0.32
DRD4 P21917 1/20 0.32
DRD5 P21918 1/20 0.32
HRH2 P25021 1/20 0.32
HTR1D P28221 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
SCHEMBL5486178 0.91 KDM4A (0.36) SLC6A4SLC6A2SLC6A3PPARGPPARD
SCHEMBL5485960 0.91 SSTR5 (0.38) SLC6A4SLC6A2SLC6A3PPARGPPARD
SCHEMBL5481894 0.83 SSTR5 (0.38) SLC6A4SLC6A2SLC6A3PPARGPPARD
SCHEMBL5498410 0.82 SLC6A2 (0.38) SLC6A4SLC6A2SLC6A3PPARGPPARD
SCHEMBL4866640 0.82 MAPT (0.41) SLC6A4SLC6A2SLC6A3HRH1HTR2B
SCHEMBL5485921 0.82 PDE10A (0.36) SLC6A4SLC6A2SLC6A3PDE10AKCNH2
SCHEMBL4593259 0.76 SSTR5 (0.42) SLC6A4SLC6A2SLC6A3TACR1HRH1
SCHEMBL5486981 0.75 SSTR5 (0.37) SLC6A4SLC6A2SLC6A3TACR1KCNH2
SCHEMBL4594422 0.75 REN (0.42) PDE10AREN
SCHEMBL4593346 0.75 PPARG (0.35) SLC6A4SLC6A2SLC6A3PPARGPPARD

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