SCHEMBL17565664

SCHEMBL17565664

CCC1(CC(F)(F)F)CCc2cc(O)ccc2C1=O

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 14/20 0.47
ESR2 Q92731 6/20 0.46
ESR1 P03372 5/20 0.46

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
SCHEMBL5282684 0.88 ESR2 (0.54) DGAT1ESR2ESR1
SCHEMBL14137121 0.85 DGAT1 (0.63) DGAT1
SCHEMBL14062343 0.85 DGAT1 (0.63) DGAT1
SCHEMBL14061891 0.85 DGAT1 (0.48) DGAT1ESR2ESR1
SCHEMBL14137124 0.83 DGAT1 (0.52) DGAT1
SCHEMBL15690662 0.83 DGAT1 (0.52) DGAT1
SCHEMBL14062083 0.81 DGAT1 (0.62) DGAT1ESR2ESR1
SCHEMBL14062151 0.81 DGAT1 (0.62) DGAT1ESR2ESR1
SCHEMBL14061848 0.78 DGAT1 (0.51) DGAT1ESR2ESR1
SCHEMBL14137087 0.78 DGAT1 (0.51) DGAT1ESR2ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9624174-B2 Compounds as diacylglycerol acyltransferase inhibitors GLAXOSMITHKLINE LLC (US) 2017-04-18 US disclosed
US-20160068487-A1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS GLAXOSMITHKLINE LLC 2016-03-10 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-20160068487-A1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS DGAT1, DGAT2, LCAT DGAT1 1/4885ESR2 211/4885ESR1 376/4885

“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.