SCHEMBL440180

SCHEMBL440180

CCN(NC(=O)c1cn(-c2ccccc2)nc1C(F)(F)F)C(=O)N1CC(C(=O)OC)C(C(F)(F)F)C1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 18/20 0.46
NTRK1 P04629 1/20 0.38
MET P08581 1/20 0.35
MST1R Q04912 1/20 0.35

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
SCHEMBL440179 0.83 DGAT1 (0.56) DGAT1
SCHEMBL463341 0.83 DGAT1 (0.56) DGAT1
SCHEMBL441022 0.81 DGAT1 (0.42) DGAT1NTRK1
SCHEMBL437411 0.80 DGAT1 (0.49) DGAT1NTRK1
SCHEMBL4910838 0.79 DGAT1 (0.56) DGAT1METMST1R
SCHEMBL4918439 0.79 DGAT1 (0.45) DGAT1
SCHEMBL440674 0.77 DGAT1 (0.44) DGAT1NTRK1
SCHEMBL440613 0.76 DGAT1 (0.44) DGAT1NTRK1
SCHEMBL4908295 0.75 DGAT1 (0.44) DGAT1NTRK1
SCHEMBL438192 0.74 DGAT1 (0.42) DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 US 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-20120065196-A1 AMIDE COMPOUNDS DGAT2, DGAT1, DLAT DGAT1 2/4885NTRK1 4754/4885MET 3442/4885

“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.