SCHEMBL16985134

SCHEMBL16985134

CCOC(=O)C1CC12CCN(c1ccc(NC(=O)c3nnc(Nc4ccc(C(F)(F)F)cc4)o3)cn1)CC2

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 20/20 0.55
ACAT1 P24752 2/20 0.54

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
SCHEMBL16969236 0.92 DGAT1 (0.65) DGAT1ACAT1
SCHEMBL16969172 0.92 DGAT1 (0.57) DGAT1ACAT1
SCHEMBL16969194 0.91 DGAT1 (0.65) DGAT1ACAT1
SCHEMBL15640094 0.90 DGAT1 (0.51) DGAT1ACAT1
SCHEMBL16985182 0.89 DGAT1 (0.62) DGAT1ACAT1
SCHEMBL16969286 0.88 DGAT1 (0.70) DGAT1ACAT1
SCHEMBL3545569 0.84 DGAT1 (0.60) DGAT1ACAT1
SCHEMBL15638574 0.83 DGAT1 (0.63) DGAT1ACAT1
SCHEMBL3541638 0.83 DGAT1 (0.61) DGAT1ACAT1
SCHEMBL3538090 0.82 DGAT1 (0.59) DGAT1ACAT1

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-9550793-B2 Spirocyclic compounds, compositions and medicinal applications thereof ADVINUS THERAPEUTICS LIMITED (IN) 2017-01-24 US disclosed
US-20150218187-A1 SPIROCYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF IMPETIS BIOSCIENCES LTD. (IN) 2015-08-06 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-20150218187-A1 SPIROCYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF DGAT1, DGAT2, CPT1A DGAT1 1/4885ACAT1 8/4885

“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.