SCHEMBL2178717

SCHEMBL2178717

O=C(Nc1ccc(-c2ccc3c(c2)C(=O)N(C2CCC(C(=O)O)CC2)C3)cc1)c1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 3/20 0.43
MCHR1 Q99705 1/20 0.42
BRD4 O60885 1/20 0.41
TMPRSS2 O15393 1/20 0.41
F10 P00742 1/20 0.40
CSNK1A1 P48729 1/20 0.39
CRBN Q96SW2 1/20 0.39
XDH P47989 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39
ABCB1 P08183 1/20 0.39
STING1 Q86WV6 1/20 0.39
HRH3 Q9Y5N1 1/20 0.38
HSD11B1 P28845 1/20 0.38

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
SCHEMBL2180602 1.00 SLC2A1 (0.43) SLC2A1MCHR1BRD4TMPRSS2F10
SCHEMBL13719179 0.92 KDM1A (0.45) MCHR1CSNK1A1CRBN
SCHEMBL13719196 0.92 KDM1A (0.45) MCHR1CSNK1A1CRBN
SCHEMBL2181173 0.90 ACHE (0.45) SLC2A1ABCB1
SCHEMBL2177538 0.90 ACHE (0.45) SLC2A1ABCB1
SCHEMBL2197846 0.89 JAK2 (0.38) BRD4
SCHEMBL2181331 0.89 SLC2A1 (0.41) SLC2A1MCHR1TMPRSS2CSNK1A1CRBN
SCHEMBL2179789 0.89 JAK2 (0.44) MCHR1ABCB1
SCHEMBL2179791 0.89 JAK2 (0.44) MCHR1ABCB1
SCHEMBL2180605 0.85 SLC2A1 (0.41) SLC2A1MCHR1BRD4TMPRSS2XDH

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-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
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 SLC2A1 464/4885MCHR1 4705/4885BRD4 2877/4885

“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.