SCHEMBL162034

SCHEMBL162034

CC(C)(CCc1ncc(-c2ccc(NC(=O)Nc3ccc(Cl)cc3Oc3ccccc3)cc2)s1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 5/20 0.62
P2RY1 P47900 1/20 0.51
CSGALNACT1 Q8TDX6 1/20 0.48
CNR1 P21554 4/20 0.44
IDO1 P14902 2/20 0.42
MAPT P10636 2/20 0.41
TP53 P04637 1/20 0.41
NTRK1 P04629 1/20 0.40
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
IGF1R P08069 2/20 0.39
ALOX5 P09917 1/20 0.39
EPHX2 P34913 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
SCHEMBL165022 0.94 DGAT1 (0.61) DGAT1P2RY1CSGALNACT1CNR1IDO1
SCHEMBL163289 0.92 DGAT1 (0.64) DGAT1P2RY1CSGALNACT1CNR1IDO1
SCHEMBL159376 0.88 DGAT1 (0.64) DGAT1P2RY1CSGALNACT1CNR1IDO1
SCHEMBL161602 0.87 DGAT1 (0.62) DGAT1P2RY1CSGALNACT1CNR1IDO1
SCHEMBL165167 0.87 DGAT1 (0.64) DGAT1P2RY1CSGALNACT1CNR1IDO1
SCHEMBL161829 0.86 DGAT1 (0.63) DGAT1P2RY1CSGALNACT1CNR1IDO1
SCHEMBL161935 0.86 DGAT1 (0.62) DGAT1P2RY1CSGALNACT1CNR1IDO1
SCHEMBL162622 0.86 DGAT1 (0.62) DGAT1P2RY1CSGALNACT1CNR1IDO1
SCHEMBL161607 0.84 DGAT1 (0.61) DGAT1P2RY1CSGALNACT1CNR1IDO1
SCHEMBL160829 0.83 DGAT1 (0.57) DGAT1CNR1MAPTTP53MEN1

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
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
EP-2611783-A2 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-07-10 EP disclosed
US-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-06-20 US disclosed
WO-2012029032-A2 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS PIRAMAL LIFE SCIENCES LIMITED (IN) 2012-03-08 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-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS DGAT1, DGAT2, SOAT1 DGAT1 1/4885P2RY1 1922/4885CSGALNACT1 750/4885

“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.