SCHEMBL10197376

SCHEMBL10197376

CCC1CCC(c2ccc(-c3ccc4c(c3)OC(CC)CN4C(=O)Nc3ccccc3C(F)(F)F)cc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.68
DGAT1 O75907 16/20 0.67
EGFR P00533 1/20 0.60
INSR P06213 1/20 0.60
PTGIR P43119 1/20 0.60
CASP9 P55211 1/20 0.60
CASP8 Q14790 1/20 0.60
SOAT2 O75908 3/20 0.54
SOAT1 P35610 2/20 0.54
CYP2C9 P11712 1/20 0.54
DGAT2 Q96PD7 1/20 0.54
GAA P10253 1/20 0.49
LMNA P02545 1/20 0.48

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
SCHEMBL409275 0.94 DGAT1 (0.78) TP53DGAT1EGFRINSRPTGIR
SCHEMBL409276 0.94 DGAT1 (0.78) TP53DGAT1EGFRINSRPTGIR
SCHEMBL10197334 0.92 DGAT1 (0.71) TP53DGAT1EGFRINSRPTGIR
SCHEMBL10197368 0.91 DGAT1 (0.65) TP53DGAT1EGFRINSRPTGIR
SCHEMBL10197367 0.90 DGAT1 (0.73) TP53DGAT1EGFRINSRPTGIR
SCHEMBL10197369 0.89 DGAT1 (0.72) TP53DGAT1EGFRINSRPTGIR
SCHEMBL10197383 0.88 DGAT1 (0.68) TP53DGAT1EGFRINSRPTGIR
SCHEMBL10197430 0.88 DGAT1 (0.70) TP53DGAT1EGFRINSRPTGIR
SCHEMBL10197345 0.86 DGAT1 (0.89) DGAT1EGFRINSRPTGIRCASP9
SCHEMBL10197468 0.86 DGAT1 (0.62) TP53DGAT1EGFRINSRPTGIR

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 TP53 4414/4885DGAT1 2/4885EGFR 4045/4885

“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.