SCHEMBL162304

SCHEMBL162304

CC(C)(CCc1ncc(-c2ccc(NC(=O)Nc3cc(F)cc(F)c3)cc2)s1)C(=O)NS(=O)(=O)C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 7/20 0.45
RIPK1 Q13546 2/20 0.35
PLK4 O00444 2/20 0.34
NTRK1 P04629 3/20 0.34
KDR P35968 3/20 0.34
KIT P10721 1/20 0.34
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CSGALNACT1 Q8TDX6 1/20 0.33
CNR1 P21554 1/20 0.33

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
SCHEMBL162644 0.89 DGAT1 (0.47) DGAT1RIPK1NTRK1KDRKIT
SCHEMBL162367 0.87 DGAT1 (0.47) DGAT1KDRKITMEN1MAPT
SCHEMBL162252 0.87 DGAT1 (0.48) DGAT1NTRK1KDRKITMEN1
SCHEMBL161878 0.85 DGAT1 (0.52) DGAT1RIPK1KDRKITMAPT
SCHEMBL161990 0.84 DGAT1 (0.51) DGAT1RIPK1PLK4NTRK1KDR
SCHEMBL160684 0.84 DGAT1 (0.49) DGAT1RIPK1NTRK1KDRKIT
SCHEMBL161575 0.82 LOXL2 (0.36)
SCHEMBL164633 0.82 DGAT1 (0.50) DGAT1RIPK1PLK4KDRKIT
SCHEMBL162302 0.79 ALDH1A1 (0.41) MEN1LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL162001 0.77 DGAT1 (0.47) DGAT1RIPK1PLK4KDRKIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2611783-A2 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-07-10 EP claimed
US-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-06-20 US claimed
WO-2012029032-A2 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS PIRAMAL LIFE SCIENCES LIMITED (IN) 2012-03-08 WO claimed
US-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-06-20 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-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS DGAT1, DGAT2, SOAT1 DGAT1 1/4885RIPK1 3390/4885PLK4 2751/4885

“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.