SCHEMBL4925846

SCHEMBL4925846

O=C(Nc1cccc(Cl)c1)NC1CCC(c2ccc(C(=O)[C@@H]3CCC[C@H]3C(=O)O)cc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 10/20 0.68
EPHX2 P34913 2/20 0.57
KMT2A Q03164 2/20 0.57
MEN1 O00255 1/20 0.57
NPC1 O15118 1/20 0.57
LMNA P02545 1/20 0.57
EPHX1 P07099 1/20 0.57
TSHR P16473 1/20 0.57
RAB9A P51151 1/20 0.57
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CXCR3 P49682 1/20 0.44
PKM P14618 1/20 0.43
ALOX15 P16050 1/20 0.43

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
SCHEMBL4925849 1.00 DGAT1 (0.68) DGAT1EPHX2KMT2AMEN1NPC1
SCHEMBL4925841 1.00 DGAT1 (0.68) DGAT1EPHX2KMT2AMEN1NPC1
SCHEMBL4920772 0.90 DGAT1 (0.55) DGAT1EPHX2KMT2AMEN1NPC1
SCHEMBL4920777 0.90 DGAT1 (0.55) DGAT1EPHX2KMT2AMEN1NPC1
SCHEMBL4920786 0.90 DGAT1 (0.55) DGAT1EPHX2KMT2AMEN1NPC1
SCHEMBL4911807 0.83 LMNA (0.70) EPHX2KMT2AMEN1NPC1LMNA
SCHEMBL17730073 0.83 LMNA (0.70) EPHX2KMT2AMEN1NPC1LMNA
SCHEMBL17730029 0.83 LMNA (0.70) EPHX2KMT2AMEN1NPC1LMNA
SCHEMBL4883194 0.81 DGAT1 (1.00) DGAT1KMT2AMEN1NPC1LMNA
SCHEMBL4890892 0.79 DGAT1 (0.96) DGAT1EPHX2KMT2AMEN1NPC1

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 3 patents. 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 claimed
US-20080064717-A1 Inhibitors of diacylglycerol O-acyltransferase type 1 enzyme ABBOTT LABORATORIES 2008-03-13 US disclosed
WO-2007137107-A2 INHIBITORS OF DIACYLGLYCEROL O-ACYLTRANSFERASE TYPE 1 ENZYME ABBOTT LABORATORIES (US) 2007-11-29 WO 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 1/4885EPHX2 1046/4885KMT2A 832/4885

“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.