SCHEMBL2179418

SCHEMBL2179418

CC(C)[C@@H](C(=O)O)N1Cc2ccc(-c3cnc(NC(=O)c4ccc(OC(F)(F)F)cc4)cn3)cc2C1=O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 12/20 0.42
THRB P10828 1/20 0.42
CYP1A2 P05177 1/20 0.40
MAP3K5 Q99683 1/20 0.38
KCNH2 Q12809 1/20 0.38
GCGR P47871 2/20 0.37
GIPR P48546 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36

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
SCHEMBL2179427 1.00 ABL1 (0.42) ABL1THRBCYP1A2MAP3K5KCNH2
SCHEMBL2179464 0.91 THRB (0.43) ABL1THRBKCNH2GSK3AGSK3B
SCHEMBL2178251 0.88 THRB (0.42) ABL1THRBMAP3K5GCGRGIPR
SCHEMBL2178242 0.88 THRB (0.42) ABL1THRBMAP3K5GCGRGIPR
SCHEMBL2179228 0.88 MAP3K5 (0.40) MAP3K5TRPV1GSK3AGSK3B
SCHEMBL2182144 0.88 MAP3K5 (0.40) MAP3K5TRPV1GSK3AGSK3B
SCHEMBL2180419 0.88 MAP3K5 (0.43) THRBMAP3K5
SCHEMBL2177079 0.88 MAP3K5 (0.43) THRBMAP3K5
SCHEMBL2179675 0.88 CHRNB2 (0.39) MAP3K5
SCHEMBL2181120 0.88 CHRNB2 (0.39) MAP3K5

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 ABL1 1175/4885THRB 2612/4885CYP1A2 1241/4885

“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.