SCHEMBL5492474

SCHEMBL5492474

CCOc1cc(CN(c2nc3cccc(C(=O)N(C)C)c3o2)C2CCNCC2)ccc1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
REN P00797 3/20 0.40
MAPT P10636 5/20 0.39
LMNA P02545 5/20 0.39
THRB P10828 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SSTR5 P35346 2/20 0.37
HRH1 P35367 1/20 0.37
HTR2B P41595 1/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
SLC6A2 P23975 3/20 0.37
SLC6A4 P31645 3/20 0.37
SLC6A3 Q01959 3/20 0.37
KCNH2 Q12809 1/20 0.37
TP53 P04637 2/20 0.36
MC4R P32245 1/20 0.36
MC5R P33032 1/20 0.36

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
SCHEMBL4866640 0.93 MAPT (0.41) POLBRENMAPTLMNATHRB
SCHEMBL5478920 0.89 LMNA (0.40) RENMAPTLMNAMEN1KMT2A
SCHEMBL5483266 0.88 MAPT (0.46) POLBMAPTLMNAMEN1KMT2A
SCHEMBL5483270 0.87 KMT2A (0.44) RENLMNAMEN1KMT2ASSTR5
SCHEMBL4593502 0.87 REN (0.39) POLBRENMAPTLMNATHRB
SCHEMBL4593955 0.86 SSTR5 (0.39) RENMAPTLMNATHRBSSTR5
SCHEMBL4594411 0.85 REN (0.43) RENMAPTSSTR5HRH1HTR2B
SCHEMBL4593591 0.85 REN (0.43) RENMAPTLMNATHRBMEN1
SCHEMBL1380771 0.84 SMN1; SMN2 (0.41) POLBRENMAPTLMNAMEN1
SCHEMBL1378225 0.84 KMT2A (0.42) RENMAPTLMNAMEN1KMT2A

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