SCHEMBL5778712

SCHEMBL5778712

CCC(=O)CN(C=O)C=O

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.45
ALDH1A1 P00352 2/20 0.32
FFAR3 O14843 1/20 0.32
TSHR P16473 1/20 0.31

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
SCHEMBL13606442 0.74 TSHR (0.32) TSHR
SCHEMBL13496940 0.72
Dimethylformamide SCHEMBL20183466 0.72 TDP1 (0.59) TDP1ALDH1A1FFAR3TSHR
SCHEMBL8998478 0.69
SCHEMBL3651498 0.69
Dimethylformamide SCHEMBL28083529 0.68 TDP1 (0.53) TDP1ALDH1A1FFAR3TSHR
Formic Acid SCHEMBL9576744 0.67
SCHEMBL16706480 0.67
SCHEMBL13755285 0.67 TDP1 (0.50) TDP1ALDH1A1FFAR3
SCHEMBL6656901 0.67 TDP1 (0.50) TDP1ALDH1A1FFAR3TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1483257-B1 QUINAZOLINE COMPOUNDS USEFUL IN THERAPY PFIZER LTD (GB) 2006-09-13 EP disclosed
US-6936619-B2 Cardiovascular disorders; antilipemic agents; sexual disorders PFIZER, INC. (US) 2005-08-30 US disclosed
US-20040029859-A1 Compounds useful in therapy PFIZER INC. 2004-02-12 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-20040029859-A1 Compounds useful in therapy ADRA1D, HSD3B1, PTGER1 TDP1 1558/4885ALDH1A1 1113/4885FFAR3 102/4885

“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.