SCHEMBL410314

SCHEMBL410314

NC(=O)C[C@H]1CC[C@H](c2ccc(-c3ccc4c(c3)CCN4C(=O)Nc3ccccc3)cc2)CC1

nearest known ligand 0.86

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 18/20 0.86
SOAT2 O75908 4/20 0.63
CYP2C9 P11712 1/20 0.59
SOAT1 P35610 1/20 0.59
DGAT2 Q96PD7 1/20 0.59
HTR2A P28223 1/20 0.55
HTR2C P28335 1/20 0.55

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
SCHEMBL410313 1.00 DGAT1 (0.86) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL10198190 1.00 DGAT1 (0.86) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL10197542 0.93 DGAT1 (1.00) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL10197146 0.93 DGAT1 (1.00) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL10197544 0.89 DGAT1 (0.83) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL3808969 0.89 DGAT1 (0.83) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL10198271 0.89 DGAT1 (0.82) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL10197244 0.87 DGAT1 (1.00) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL383634 0.87 DGAT1 (1.00) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL383635 0.87 DGAT1 (1.00) DGAT1SOAT2CYP2C9SOAT1DGAT2

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-20120022057-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF DIACYGLYCEROL ACYLTRANSFERASE SCHERING CORPORATION (US) 2012-01-26 US disclosed
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 2/4885SOAT2 9/4885CYP2C9 1475/4885

“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.