SCHEMBL2301986

SCHEMBL2301986

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

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSGALNACT1 Q8TDX6 7/20 0.53
DGAT1 O75907 2/20 0.53
RAB9A P51151 6/20 0.43
MAPT P10636 5/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
NPC1 O15118 5/20 0.43
HPGD P15428 3/20 0.41
ALDH1A1 P00352 3/20 0.41
GAA P10253 2/20 0.41
ALPL P05186 1/20 0.41
PDPK1 O15530 1/20 0.41
DYRK1A Q13627 1/20 0.41
KDM4E B2RXH2 3/20 0.41
LMNA P02545 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
HTT P42858 2/20 0.41
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL2301962 1.00 CSGALNACT1 (0.53) CSGALNACT1DGAT1RAB9AMAPTSMN1; SMN2
SCHEMBL2299252 0.92 DGAT1 (0.47) CSGALNACT1DGAT1RAB9AMAPTSMN1; SMN2
SCHEMBL2299258 0.92 DGAT1 (0.47) CSGALNACT1DGAT1RAB9AMAPTSMN1; SMN2
SCHEMBL2298917 0.92 CSGALNACT1 (0.56) CSGALNACT1DGAT1RAB9AMAPTSMN1; SMN2
SCHEMBL2298935 0.92 CSGALNACT1 (0.56) CSGALNACT1DGAT1RAB9AMAPTSMN1; SMN2
SCHEMBL2298195 0.90 CSGALNACT1 (0.50) CSGALNACT1DGAT1RAB9AMAPTSMN1; SMN2
SCHEMBL2298179 0.90 CSGALNACT1 (0.50) CSGALNACT1DGAT1RAB9AMAPTSMN1; SMN2
SCHEMBL2294918 0.89 CSGALNACT1 (0.51) CSGALNACT1DGAT1RAB9AMAPTSMN1; SMN2
SCHEMBL2294934 0.89 CSGALNACT1 (0.51) CSGALNACT1DGAT1RAB9AMAPTSMN1; SMN2
SCHEMBL2294926 0.89 CSGALNACT1 (0.51) CSGALNACT1DGAT1RAB9AMAPTSMN1; SMN2

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 CSGALNACT1 455/4885DGAT1 1/4885RAB9A 3753/4885

“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.