SCHEMBL3673344

SCHEMBL3673344

O=C(Nc1nnc(Cc2ccccc2)s1)c1ccc(C2CC[CH]CC2)cc1

nearest known ligand 0.76

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 17/20 0.76
MEN1 O00255 1/20 0.69
NPC1 O15118 1/20 0.69
RAB9A P51151 1/20 0.69
KMT2A Q03164 1/20 0.69
RXFP1 Q9HBX9 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58

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
SCHEMBL3672639 0.90 DGAT1 (0.78) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL3673362 0.90 DGAT1 (0.76) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL3674889 0.90 DGAT1 (0.76) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL3665909 0.90 RXFP1 (0.66) DGAT1MEN1NPC1RAB9AKMT2A
Bicarbonate SCHEMBL15655199 0.89 DGAT1 (0.76) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL3672844 0.89 DGAT1 (0.76) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL3671468 0.89 DGAT1 (0.80) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL602580 0.88 DGAT1 (0.78) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL603709 0.88 DGAT1 (0.78) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL3670116 0.88 DGAT1 (0.77) DGAT1MEN1NPC1RAB9AKMT2A

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