SCHEMBL3674889

SCHEMBL3674889

O=C(Nc1nnc(Cc2ccc(Cl)cc2)s1)c1ccc(C2CC[CH]CC2)cc1

nearest known ligand 0.76

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 13/20 0.76
L3MBTL1 Q9Y468 1/20 0.65
POLB P06746 2/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
ALDH1A1 P00352 1/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
RXFP1 Q9HBX9 1/20 0.52

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
SCHEMBL3665909 0.90 RXFP1 (0.66) DGAT1L3MBTL1MEN1KMT2ANPC1
SCHEMBL3673362 0.90 DGAT1 (0.76) DGAT1MEN1KMT2ANPC1RAB9A
SCHEMBL3673344 0.90 DGAT1 (0.76) DGAT1MEN1KMT2ANPC1RAB9A
SCHEMBL3669882 0.88 DGAT1 (0.77) DGAT1MEN1KMT2ANPC1RAB9A
SCHEMBL3674728 0.87 DGAT1 (0.77) DGAT1MEN1KMT2AALDH1A1NPC1
SCHEMBL602563 0.86 DGAT1 (1.00) DGAT1
SCHEMBL3670233 0.84 DGAT1 (0.77) DGAT1
SCHEMBL3670116 0.82 DGAT1 (0.77) DGAT1MEN1KMT2ANPC1RAB9A
SCHEMBL3672639 0.80 DGAT1 (0.78) DGAT1MEN1KMT2ANPC1RAB9A
SCHEMBL3679276 0.80 DGAT1 (0.76) DGAT1

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-2391611-A1 THIADIAZOLE AND OXADIAZOLE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-12-07 EP claimed
WO-2010086551-A1 THIADIAZOLE AND OXADIAZOLE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-08-05 WO claimed
EP-2391611-A1 THIADIAZOLE AND OXADIAZOLE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-12-07 EP disclosed
WO-2010086551-A1 THIADIAZOLE AND OXADIAZOLE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-08-05 WO disclosed