SCHEMBL10198286

SCHEMBL10198286

CCC1CCC(c2ccc(-c3ccc4c(c3)CCN4C(=O)Nc3ccccc3Cl)cc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 13/20 0.64
EGFR P00533 1/20 0.47
INSR P06213 1/20 0.47
PTGIR P43119 1/20 0.47
CASP9 P55211 1/20 0.47
CASP8 Q14790 1/20 0.47
MAPT P10636 2/20 0.47
TP53 P04637 1/20 0.47
SOAT2 O75908 1/20 0.46
PTPN11 Q06124 1/20 0.46
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL384026 0.90 DGAT1 (0.79) DGAT1EGFRINSRPTGIRCASP9
SCHEMBL384027 0.90 DGAT1 (0.79) DGAT1EGFRINSRPTGIRCASP9
SCHEMBL10198274 0.90 DGAT1 (0.65) DGAT1EGFRINSRPTGIRCASP9
SCHEMBL10198304 0.89 DGAT1 (0.64) DGAT1EGFRINSRPTGIRCASP9
SCHEMBL10198271 0.87 DGAT1 (0.82) DGAT1TP53SOAT2HTR2AHTR2C
SCHEMBL10260020 0.87 DGAT1 (0.63) DGAT1EGFRINSRPTGIRCASP9
SCHEMBL10198272 0.85 DGAT1 (0.68) DGAT1SOAT2PTPN11HTR2AHTR2C
SCHEMBL10198290 0.85 DGAT1 (0.68) DGAT1SOAT2PTPN11HTR2AHTR2C
SCHEMBL10198281 0.84 DGAT1 (0.66) DGAT1SOAT2HTR2AHTR2C
SCHEMBL10198275 0.83 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.