SCHEMBL612123

SCHEMBL612123

C#CC[C@@]1(O)C[C@H]2CC[C@]1(C)C2(C)C

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.30
SLC6A1 P30531 1/20 0.30
SLC6A12 P48065 1/20 0.30
SLC6A11 P48066 1/20 0.30

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
SCHEMBL12231026 1.00 L3MBTL1 (0.30) L3MBTL1SLC6A1SLC6A12SLC6A11
SCHEMBL9823374 0.78 SLC6A1 (0.33) L3MBTL1SLC6A1SLC6A12SLC6A11
SCHEMBL9823369 0.78 SLC6A1 (0.33) L3MBTL1SLC6A1SLC6A12SLC6A11
SCHEMBL8133320 0.78 SLC6A1 (0.33) L3MBTL1SLC6A1SLC6A12SLC6A11
SCHEMBL7755842 0.76 GPBAR1 (0.34) L3MBTL1SLC6A1SLC6A12SLC6A11
SCHEMBL4612981 0.75 SLC6A1 (0.31) SLC6A1SLC6A12SLC6A11
SCHEMBL8755099 0.75 SLC6A1 (0.31) SLC6A1SLC6A12SLC6A11
SCHEMBL7757782 0.75 L3MBTL1 (0.36) L3MBTL1
SCHEMBL9118328 0.73 SHBG (0.38)
SCHEMBL9118331 0.73 SHBG (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8557828-B2 Inhibitors of diacylglycerol O-acyltransferase type 1 enzyme ABBVIE INC. (US) 2013-10-15 US disclosed
EP-2142552-B1 INHIBITORS OF DIACYLGLYCEROL O-ACYLTRANSFERASE TYPE 1 ENZYME ABBOTT LAB (US) 2012-08-01 EP disclosed
US-20120041003-A1 INHIBITORS OF DIACYLGLYCEROL O-ACYLTRANSFERASE TYPE 1 ENZYME ABBOTT LABORATORIES (US) 2012-02-16 US disclosed
US-8076344-B2 Inhibitors of diacylglycerol O-acyltransferase type 1 enzyme ABBOTT LABORATORIES (US) 2011-12-13 US disclosed
US-20080293713-A1 Inhibitors of Diacylglycerol O-acyltransferase Type 1 Enzyme ABBOTT LABORATORIES (US) 2008-11-27 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 (2 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-20120041003-A1 INHIBITORS OF DIACYLGLYCEROL O-ACYLTRANSFERASE TYPE 1 ENZYME DGAT1, DGAT2, LCAT L3MBTL1 843/4885SLC6A1 2852/4885SLC6A12 4161/4885
US-20080293713-A1 Inhibitors of Diacylglycerol O-acyltransferase Type 1 Enzyme DGAT1, DGAT2, LCAT L3MBTL1 843/4885SLC6A1 2852/4885SLC6A12 4161/4885

“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.