SCHEMBL21802037

SCHEMBL21802037

O=C(O)[C@@H]1COCC(=O)N1C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 1/20 0.32
ACE P12821 2/20 0.31
ITGB1 P05556 1/20 0.31
ITGA5 P08648 1/20 0.31
P2RX7 Q99572 2/20 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
SCHEMBL23123431 0.77 NAAA (0.32)
SCHEMBL18612421 0.77 AGTR2 (0.32) AGTR2P2RX7
SCHEMBL23123714 0.77 NAAA (0.32)
SCHEMBL6806230 0.72 NAAA (0.33) ACE
SCHEMBL2712732 0.69 ACE (0.56) ACEITGB1ITGA5P2RX7
SCHEMBL2715722 0.69 ACE (0.56) ACEITGB1ITGA5P2RX7
SCHEMBL2805870 0.69 ACE (0.56) ACEITGB1ITGA5P2RX7
SCHEMBL1190522 0.67 P2RX7 (0.58) AGTR2ACEP2RX7
SCHEMBL23452178 0.67 ITGB1 (0.38) ACEITGB1ITGA5
SCHEMBL23452176 0.67 ITGB1 (0.38) ACEITGB1ITGA5

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-3559007-B1 SULFONAMIDE COMPOUNDS HAVING TNAP INHIBITORY ACTIVITY DAIICHI SANKYO CO LTD (JP) 2023-08-16 EP disclosed
US-11046710-B2 Sulfonamide compounds DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-06-29 US disclosed
US-11014939-B2 2021-05-25 US disclosed
US-20200087321-A1 SULFONAMIDE COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2020-03-19 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 (3 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-20200087321-A1 SULFONAMIDE COMPOUNDS ALPI, ASAH2, STS AGTR2 215/4885ACE 60/4885ITGB1 4582/4885
US-11014939-B2 ALPI, ALPP, ACER2 AGTR2 73/4885ACE 55/4885ITGB1 3958/4885
US-11046710-B2 Sulfonamide compounds ALPI, ASAH2, STS AGTR2 215/4885ACE 60/4885ITGB1 4582/4885

“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.