SCHEMBL2179478

SCHEMBL2179478

COC(=O)C1(N2Cc3ccc(-c4ccc(NC(=O)c5ccc(Cl)cc5)cc4)cc3C2=O)CC1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 9/20 0.44
SLC2A1 P11166 2/20 0.43
GSK3B P49841 1/20 0.41
TMPRSS2 O15393 1/20 0.41
PLAU P00749 1/20 0.41
MCHR1 Q99705 3/20 0.41
PTPN1 P18031 1/20 0.40
TRPV1 Q8NER1 1/20 0.39

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
SCHEMBL2179848 0.96 ABCB1 (0.43) ABCB1SLC2A1GSK3BTMPRSS2PLAU
SCHEMBL13718913 0.96 ABCB1 (0.43) ABCB1SLC2A1GSK3BTMPRSS2PLAU
SCHEMBL2178666 0.89 SLC2A1 (0.47) ABCB1SLC2A1TMPRSS2MCHR1
SCHEMBL2199151 0.89 MAPK1 (0.38) ABCB1GSK3B
SCHEMBL13719131 0.89 MEN1 (0.46) ABCB1PLAUMCHR1PTPN1TRPV1
SCHEMBL2181272 0.88 NPC1 (0.43) ABCB1TMPRSS2MCHR1TRPV1
SCHEMBL13718891 0.88 PTPN1 (0.44) PLAUMCHR1PTPN1TRPV1
SCHEMBL13719112 0.88 PTPN1 (0.44) PLAUMCHR1PTPN1TRPV1
SCHEMBL13719331 0.86 MAPT (0.41) TRPV1
SCHEMBL2178864 0.86 SLC2A1 (0.46) ABCB1SLC2A1TMPRSS2MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8748426-B2 Inhibitors of diacylglycerol acyl transferase Piramal Enterprises Limited (IN) 2014-06-10 US claimed
US-20120289505-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE Piramal Enterprises Limited (IN) 2012-11-15 US claimed
EP-2519500-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE Piramal Healthcare Ltd. (IN) 2012-11-07 EP claimed
WO-2011080718-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-07-07 WO claimed
US-8748426-B2 Inhibitors of diacylglycerol acyl transferase Piramal Enterprises Limited (IN) 2014-06-10 US disclosed
US-20120289505-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE Piramal Enterprises Limited (IN) 2012-11-15 US disclosed
EP-2519500-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE Piramal Healthcare Ltd. (IN) 2012-11-07 EP disclosed
WO-2011080718-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-07-07 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-20120289505-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE DGAT1, DGAT2, LCAT ABCB1 1179/4885SLC2A1 464/4885GSK3B 760/4885

“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.