SCHEMBL405067

SCHEMBL405067

O=C(O)C[C@H]1CC[C@H](c2ccc(-c3ccc4c(c3)CCN4)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 19/20 0.54
SOAT1 P35610 4/20 0.47
SOAT2 O75908 1/20 0.45
FAAH O00519 1/20 0.43
CHRM2 P08172 1/20 0.43
DGAT2 Q96PD7 1/20 0.43
PDE10A Q9Y233 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
SCHEMBL384873 1.00 DGAT1 (0.54) DGAT1SOAT1SOAT2FAAHCHRM2
SCHEMBL463588 0.86 DGAT1 (0.44) DGAT1SOAT1SOAT2
SCHEMBL463587 0.86 DGAT1 (0.44) DGAT1SOAT1SOAT2
SCHEMBL13190255 0.78 EPHX2 (0.46)
SCHEMBL4940938 0.75 DGAT1 (0.59) DGAT1SOAT1SOAT2FAAHCHRM2
SCHEMBL409806 0.74 DGAT1 (0.55) DGAT1SOAT1SOAT2DGAT2
SCHEMBL409807 0.74 DGAT1 (0.55) DGAT1SOAT1SOAT2DGAT2
SCHEMBL460440 0.73 DGAT1 (0.48) DGAT1SOAT1SOAT2
SCHEMBL460439 0.73 DGAT1 (0.48) DGAT1SOAT1SOAT2
SCHEMBL463281 0.73 DGAT1 (0.86) DGAT1SOAT1SOAT2DGAT2

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-20120022057-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF DIACYGLYCEROL ACYLTRANSFERASE SCHERING CORPORATION (US) 2012-01-26 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-20120022057-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF DIACYGLYCEROL ACYLTRANSFERASE DGAT2, DGAT1, LCAT DGAT1 2/4885SOAT1 18/4885SOAT2 9/4885

“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.