SCHEMBL407232

SCHEMBL407232

Cn1cc(-n2cc(C(=O)O)c(C(F)(F)F)n2)cn1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 14/20 0.40
GAA P10253 1/20 0.39
POLB P06746 2/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL408655 0.83 KDM4E (0.45) DGAT1GAALMNAMAPTSMN1; SMN2
SCHEMBL408273 0.79 DGAT1 (0.54) DGAT1POLBLMNAMAPTSMN1; SMN2
SCHEMBL353314 0.78 GAA (0.56) GAAPOLBLMNA
SCHEMBL19182678 0.78 GAA (0.56) GAAPOLBLMNA
Hydrochloric Acid SCHEMBL8355477 0.77 GAA (0.55) GAAPOLBLMNA
SCHEMBL408898 0.77 DGAT1 (0.48) DGAT1LMNASMN1; SMN2
SCHEMBL4293751 0.77 ALDH1A1 (0.54) DGAT1LMNAMAPTSMN1; SMN2
SCHEMBL408727 0.77 DGAT1 (0.39) DGAT1SMN1; SMN2
SCHEMBL407419 0.75 DGAT1 (0.54) DGAT1GAAPOLBLMNAMAPT
SCHEMBL14319143 0.75 DGAT1 (0.45) DGAT1SMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 US disclosed
US-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 US disclosed
US-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 US disclosed
WO-2008011130-A2 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-24 WO 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-20120065196-A1 AMIDE COMPOUNDS DGAT2, DGAT1, DLAT DGAT1 2/4885GAA 106/4885POLB 2752/4885

“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.