SCHEMBL6175673

SCHEMBL6175673

O=C(O)CC(Cc1ccc(O)cc1)c1nccs1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSA P10619 18/20 0.45
PKM P14618 1/20 0.40
SLC7A5 Q01650 1/20 0.40

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
SCHEMBL6177067 1.00 CTSA (0.45) CTSAPKMSLC7A5
SCHEMBL6179589 1.00 CTSA (0.45) CTSAPKMSLC7A5
SCHEMBL27535196 0.84 ESR1 (0.41) CTSAPKM
SCHEMBL27535188 0.82 PKM (0.42) CTSAPKM
SCHEMBL3519472 0.78 CTSA (0.61) CTSA
SCHEMBL2039261 0.76 CTSA (0.48) CTSA
SCHEMBL6493992 0.76 CTSA (0.46) CTSAPKM
SCHEMBL6176693 0.76 PKM (0.44) PKMSLC7A5
SCHEMBL7825710 0.75 CTSA (0.47) CTSA
SCHEMBL6177437 0.74 MIF (0.42) PKMSLC7A5

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
EP-1061921-A4 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2005-03-30 EP disclosed
US-20020147334-A1 Vitronectin Receptor Antagonists SMITHKLINE BEECHAM CORPORATION 2002-10-10 US disclosed
EP-1061921-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2000-12-27 EP disclosed
WO-1999045927-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-09-16 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-20020147334-A1 Vitronectin Receptor Antagonists ADGRF1, FN1, CALCR CTSA 1169/4885PKM 4524/4885SLC7A5 2764/4885

“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.