SCHEMBL4882136

SCHEMBL4882136

O=C(Nc1ccc(-c2ccc(C(=O)[C@@H]3CCC[C@H]3C(=O)O)cc2)cc1)Nc1ccccc1Cl

nearest known ligand 0.78

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 17/20 0.78
CYP2C19 P33261 1/20 0.56
RAB9A P51151 2/20 0.53
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
NPC1 O15118 1/20 0.53
POLB P06746 1/20 0.53
GAA P10253 1/20 0.53
MAPT P10636 1/20 0.53
MAPK1 P28482 1/20 0.53
KMT2A Q03164 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
LMNA P02545 1/20 0.51

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
SCHEMBL4221429 0.89 DGAT1 (0.60) DGAT1RAB9AKDM4EMEN1NPC1
SCHEMBL4221434 0.89 DGAT1 (0.60) DGAT1RAB9AKDM4EMEN1NPC1
SCHEMBL21995882 0.88 DGAT1 (1.00) DGAT1RAB9AGAAMAPTLMNA
SCHEMBL5372960 0.88 DGAT1 (1.00) DGAT1RAB9AGAAMAPTLMNA
SCHEMBL2742723 0.88 DGAT1 (1.00) DGAT1RAB9AGAAMAPTLMNA
SCHEMBL4890678 0.87 DGAT1 (0.80) DGAT1RAB9AKDM4EMEN1NPC1
SCHEMBL4886387 0.86 DGAT1 (0.81) DGAT1RAB9APOLBLMNA
SCHEMBL4890716 0.84 DGAT1 (1.00) DGAT1RAB9AKDM4EMEN1NPC1
SCHEMBL4883194 0.82 DGAT1 (1.00) DGAT1RAB9AMEN1NPC1MAPT
SCHEMBL4894007 0.82 DGAT1 (0.96) DGAT1RAB9AKDM4EMEN1NPC1

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 1/4885CYP2C19 2428/4885RAB9A 1464/4885

“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.