SCHEMBL4885309

SCHEMBL4885309

O=C(Nc1ccc(-c2ccc(C(=O)[C@@H]3CCC[C@H]3C(=O)O)cc2)cc1)Nc1cccnc1

nearest known ligand 0.78

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 17/20 0.78
RAB9A P51151 3/20 0.54
NPC1 O15118 2/20 0.54
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51
NAMPT P43490 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL4889152 1.00 DGAT1 (0.78) DGAT1RAB9ANPC1LMNAGAA
SCHEMBL13752606 0.98 DGAT1 (0.74) DGAT1RAB9ANPC1LMNAGAA
SCHEMBL4235270 0.89 DGAT1 (0.60) DGAT1RAB9ANPC1LMNAGAA
SCHEMBL4235278 0.89 DGAT1 (0.60) DGAT1RAB9ANPC1LMNAGAA
SCHEMBL2742723 0.88 DGAT1 (1.00) DGAT1RAB9ALMNAGAA
SCHEMBL5372960 0.88 DGAT1 (1.00) DGAT1RAB9ALMNAGAA
SCHEMBL21995882 0.88 DGAT1 (1.00) DGAT1RAB9ALMNAGAA
SCHEMBL4916293 0.81 DGAT1 (0.77) DGAT1
SCHEMBL4888778 0.81 DGAT1 (0.81) DGAT1RAB9ALMNA
SCHEMBL4886387 0.81 DGAT1 (0.81) DGAT1RAB9ALMNA

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-20080015227-A1 Inhibitors of diacylglycerol O-acyltransferase type 1 enzyme ABBOTT LABORATORIES 2008-01-17 US claimed
US-20080015227-A1 Inhibitors of diacylglycerol O-acyltransferase type 1 enzyme ABBOTT LABORATORIES 2008-01-17 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-20080015227-A1 Inhibitors of diacylglycerol O-acyltransferase type 1 enzyme DGAT1, DGAT2, LCAT DGAT1 1/4885RAB9A 1464/4885NPC1 107/4885

“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.