SCHEMBL2296328

SCHEMBL2296328

O=C(O)CNC(=S)c1cc(-c2ccc(Nc3nc4ccc(F)cc4s3)cc2)no1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.48
SMN1; SMN2 Q16637 6/20 0.48
NPC1 O15118 6/20 0.48
MAPT P10636 6/20 0.48
DGAT1 O75907 2/20 0.47
CSGALNACT1 Q8TDX6 1/20 0.47
PDPK1 O15530 1/20 0.43
DYRK1A Q13627 1/20 0.43
KMT2A Q03164 4/20 0.43
HPGD P15428 3/20 0.43
MEN1 O00255 3/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 3/20 0.43
LMNA P02545 3/20 0.43
HTT P42858 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
USP2 O75604 1/20 0.43
TP53 P04637 1/20 0.43
CASP1 P29466 1/20 0.43
CASP3 P42574 1/20 0.43

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
SCHEMBL2298815 0.91 DGAT1 (0.51) RAB9ASMN1; SMN2NPC1MAPTDGAT1
SCHEMBL2296242 0.91 MAPT (0.46) RAB9ASMN1; SMN2NPC1MAPTDGAT1
SCHEMBL2294548 0.86 NPC1 (0.57) RAB9ASMN1; SMN2NPC1MAPTDGAT1
SCHEMBL2299637 0.84 DGAT1 (0.47) RAB9ASMN1; SMN2NPC1MAPTDGAT1
SCHEMBL2297494 0.84 MAPT (0.54) RAB9ASMN1; SMN2NPC1MAPTDGAT1
SCHEMBL2296238 0.84 SMN1; SMN2 (0.54) RAB9ASMN1; SMN2NPC1MAPTDGAT1
SCHEMBL2297826 0.83 CSGALNACT1 (0.66) RAB9ASMN1; SMN2NPC1MAPTDGAT1
SCHEMBL2299494 0.83 CSGALNACT1 (0.66) RAB9ASMN1; SMN2NPC1MAPTDGAT1
SCHEMBL2298785 0.83 SMN1; SMN2 (0.45) RAB9ASMN1; SMN2NPC1MAPTDGAT1
SCHEMBL2297843 0.83 CSGALNACT1 (0.66) RAB9ASMN1; SMN2NPC1MAPTDGAT1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8835428-B2 Diacylglycerol acyltransferase inhibitors Piramal Enterprises Limited (IN) 2014-09-16 US claimed
US-20110196002-A1 DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS PIRAMAL LIFE SCIENCES LIMITED. 2011-08-11 US claimed
WO-2010023609-A1 OXAZOLE, OXADIAZOLE AND THIAZOLE DERIVATIVES AS DIACYLGLYCEROL ACYLTRANFERASE INHIBITORS PIRAMAL LIFE SCIENCES LIMITED (IN) 2010-03-04 WO claimed
US-8835428-B2 Diacylglycerol acyltransferase inhibitors Piramal Enterprises Limited (IN) 2014-09-16 US disclosed
US-20110196002-A1 DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS PIRAMAL LIFE SCIENCES LIMITED. 2011-08-11 US disclosed
WO-2010023609-A1 OXAZOLE, OXADIAZOLE AND THIAZOLE DERIVATIVES AS DIACYLGLYCEROL ACYLTRANFERASE INHIBITORS PIRAMAL LIFE SCIENCES LIMITED (IN) 2010-03-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110196002-A1 DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS DGAT1, DGAT2, DLAT RAB9A 3753/4885SMN1; SMN2 4532/4885NPC1 436/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.