SCHEMBL2295820

SCHEMBL2295820

COC(=O)C1(NC(=S)c2cc(-c3ccc(Nc4nc5ccc(F)cc5s4)cc3)no2)CCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.43
CSGALNACT1 Q8TDX6 1/20 0.43
MAPT P10636 10/20 0.43
SMN1; SMN2 Q16637 10/20 0.43
HPGD P15428 5/20 0.43
KDM4E B2RXH2 5/20 0.43
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
LMNA P02545 4/20 0.43
GAA P10253 3/20 0.43
HTT P42858 2/20 0.43
MCL1 Q07820 2/20 0.43
TNF P01375 1/20 0.43
NR2F2 P24468 1/20 0.43
KLF5 Q13887 1/20 0.43
NOD1 Q9Y239 1/20 0.43
RAB9A P51151 10/20 0.41
NPC1 O15118 9/20 0.41
PDPK1 O15530 1/20 0.41
DYRK1A Q13627 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
SCHEMBL2294242 0.93 DGAT1 (0.46) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2298785 0.91 SMN1; SMN2 (0.45) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2296550 0.84 DGAT1 (0.47) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2299637 0.83 DGAT1 (0.47) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2296242 0.82 MAPT (0.46) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2297708 0.81 SMN1; SMN2 (0.43) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2297703 0.81 SMN1; SMN2 (0.43) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2298968 0.81 DGAT1 (0.46) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2298961 0.81 DGAT1 (0.46) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2294893 0.80 CSGALNACT1 (0.55) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD

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 DGAT1 1/4885CSGALNACT1 455/4885MAPT 1278/4885

“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.