SCHEMBL10198274

SCHEMBL10198274

CCC1CCC(c2ccc(-c3ccc4c(c3)CCN4C(=O)Nc3ccccc3C)cc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 15/20 0.65
EGFR P00533 1/20 0.48
INSR P06213 1/20 0.48
PTGIR P43119 1/20 0.48
CASP9 P55211 1/20 0.48
CASP8 Q14790 1/20 0.48
SOAT2 O75908 1/20 0.47
MAPT P10636 1/20 0.46
ITGB1 P05556 1/20 0.45
ITGA4 P13612 1/20 0.45
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45

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
SCHEMBL405482 0.91 DGAT1 (0.79) DGAT1EGFRINSRPTGIRCASP9
SCHEMBL405481 0.91 DGAT1 (0.79) DGAT1EGFRINSRPTGIRCASP9
SCHEMBL10198286 0.90 DGAT1 (0.64) DGAT1EGFRINSRPTGIRCASP9
SCHEMBL10198304 0.90 DGAT1 (0.64) DGAT1EGFRINSRPTGIRCASP9
SCHEMBL13190447 0.89 DGAT1 (0.58) DGAT1MAPTITGB1ITGA4HTR2A
SCHEMBL10198271 0.88 DGAT1 (0.82) DGAT1SOAT2HTR2AHTR2C
SCHEMBL10260020 0.88 DGAT1 (0.63) DGAT1EGFRINSRPTGIRCASP9
SCHEMBL10198301 0.85 DGAT1 (0.69) DGAT1SOAT2MAPTHTR2AHTR2C
SCHEMBL10198278 0.85 DGAT1 (0.69) DGAT1SOAT2MAPTHTR2AHTR2C
SCHEMBL10198275 0.84 DGAT1 (0.62) DGAT1SOAT2HTR2AHTR2C

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 2/4885EGFR 4045/4885INSR 285/4885

“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.