SCHEMBL4913997

SCHEMBL4913997

O=C(O)[C@@H]1CCC[C@H]1C(=O)c1ccc(-c2ccc([N+](=O)[O-])s2)cc1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 15/20 0.47
CYP2A6 P11509 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
RAB9A P51151 1/20 0.38
APP P05067 1/20 0.37

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
SCHEMBL4913567 0.81 DGAT1 (0.52) DGAT1
SCHEMBL4886823 0.79 DGAT1 (0.56) DGAT1
SCHEMBL4921471 0.71 DGAT1 (0.73) DGAT1
SCHEMBL6031922 0.70 DGAT1 (0.62) DGAT1RAB9A
SCHEMBL594904 0.70 DGAT1 (0.62) DGAT1RAB9A
SCHEMBL3634560 0.70 DGAT1 (0.62) DGAT1RAB9A
SCHEMBL594903 0.70 DGAT1 (0.62) DGAT1RAB9A
SCHEMBL594902 0.70 DGAT1 (0.62) DGAT1RAB9A
SCHEMBL14124762 0.70 DGAT1 (0.69) DGAT1SMN1; SMN2RAB9A
SCHEMBL6067937 0.69 CYP2A6 (0.67) CYP2A6RAB9AAPP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080064717-A1 Inhibitors of diacylglycerol O-acyltransferase type 1 enzyme ABBOTT LABORATORIES 2008-03-13 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-20080064717-A1 Inhibitors of diacylglycerol O-acyltransferase type 1 enzyme DGAT1, DGAT2, DLAT DGAT1 1/4885CYP2A6 1120/4885SMN1; SMN2 4202/4885

“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.