SCHEMBL4949261

SCHEMBL4949261

CCOc1cc(CN2CCC(Nc3nc4cc(N)ccc4o3)CC2)ccc1Cl

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 19/20 0.81
HRH1 P35367 7/20 0.81
HTR2B P41595 2/20 0.81
SSTR1 P30872 2/20 0.65
KCNH2 Q12809 2/20 0.64

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
SCHEMBL3582082 0.92 SSTR5 (0.87) SSTR5HRH1HTR2BSSTR1KCNH2
SCHEMBL4944653 0.90 SSTR5 (0.80) SSTR5HRH1HTR2BSSTR1KCNH2
SCHEMBL4951995 0.90 SSTR5 (0.80) SSTR5HRH1HTR2BSSTR1KCNH2
SCHEMBL4944799 0.90 SSTR5 (0.82) SSTR5HRH1HTR2BSSTR1KCNH2
SCHEMBL4952336 0.90 SSTR5 (0.81) SSTR5HRH1HTR2BSSTR1KCNH2
SCHEMBL3573210 0.89 SSTR5 (1.00) SSTR5HRH1HTR2B
SCHEMBL4947648 0.89 SSTR5 (0.83) SSTR5HRH1HTR2BSSTR1KCNH2
SCHEMBL3633290 0.88 SSTR5 (1.00) SSTR5HRH1HTR2BSSTR1KCNH2
SCHEMBL4947594 0.88 SSTR5 (0.80) SSTR5HRH1HTR2BSSTR1KCNH2
SCHEMBL1379959 0.88 SSTR5 (0.87) SSTR5HRH1HTR2BSSTR1KCNH2

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-B1 BENZOTHIAZOLE, THIAZOLOPYRIDINE, BENZOOXAZOLE AND OXAZOLOPYRIDINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS HOFFMANN LA ROCHE (CH) 2008-11-05 EP claimed
EP-1858901-B1 BENZOTHIAZOLE, THIAZOLOPYRIDINE, BENZOOXAZOLE AND OXAZOLOPYRIDINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS HOFFMANN LA ROCHE (CH) 2008-11-05 EP disclosed