SCHEMBL4594470

SCHEMBL4594470

CCCOc1ccc2oc(N(Cc3cc(OCC)c(-c4ccc(F)cc4)c(OCC)c3)C3CCNCC3)nc2c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 12/20 0.36
KCNH2 Q12809 5/20 0.36
SSTR3 P32745 1/20 0.36
SSTR1 P30872 1/20 0.35
PPARD Q03181 4/20 0.34
PPARA Q07869 4/20 0.34
PPARG P37231 3/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
DRD2 P14416 1/20 0.33
GRK2 P25098 1/20 0.32
GRK5 P34947 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
SCHEMBL4593240 0.95 SSTR5 (0.36) SSTR5KCNH2SSTR3SSTR1PPARD
SCHEMBL4594449 0.93 SSTR5 (0.36) SSTR5KCNH2SSTR3SSTR1PPARD
SCHEMBL4593947 0.90 SSTR5 (0.35) SSTR5KCNH2SSTR3SSTR1SLC6A2
SCHEMBL4594815 0.89 NPC1 (0.40) SSTR5KCNH2SSTR3SSTR1
SCHEMBL4593376 0.89 SSTR5 (0.36) SSTR5KCNH2SSTR3SSTR1SLC6A2
SCHEMBL4594566 0.88 HTR2A (0.35) SSTR5KCNH2SSTR3SSTR1PPARD
SCHEMBL4593265 0.87 SSTR5 (0.40) SSTR5KCNH2SSTR3SSTR1PPARD
SCHEMBL4594753 0.86 MAPT (0.37) SSTR5KCNH2SSTR1
SCHEMBL4593907 0.86 SSTR5 (0.37) SSTR5KCNH2PPARDPPARAPPARG
SCHEMBL4595027 0.85 SSTR5 (0.47) SSTR5KCNH2SSTR1

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