SCHEMBL4739555

SCHEMBL4739555

Nc1ccc(C(=O)N2CCCC2C(=O)O)cc1

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.70
▸ ALDH1A1 P00352 3/20 0.63
▸ L3MBTL1 Q9Y468 2/20 0.60
▸ TDP1 Q9NUW8 1/20 0.59
▸ NPSR1 Q6W5P4 1/20 0.56
▸ HSD11B1 P28845 2/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ GAA P10253 1/20 0.47
▸ HPGD P15428 1/20 0.47

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
SCHEMBL6787910 0.92 CA2 (0.75) CA2ALDH1A1L3MBTL1TDP1NPSR1
SCHEMBL5537767 0.92 CA2 (0.75) CA2ALDH1A1L3MBTL1TDP1NPSR1
SCHEMBL15227905 0.89 CA2 (0.58) CA2ALDH1A1L3MBTL1TDP1NPSR1
SCHEMBL28789388 0.85 CA2 (0.67) CA2ALDH1A1L3MBTL1TDP1NPSR1
SCHEMBL13229 0.85 CA2 (0.67) CA2ALDH1A1L3MBTL1TDP1NPSR1
SCHEMBL13230 0.85 CA2 (0.67) CA2ALDH1A1L3MBTL1TDP1NPSR1
SCHEMBL12302088 0.84 ALDH1A1 (0.67) CA2ALDH1A1L3MBTL1TDP1NPSR1
SCHEMBL6290808 0.84 CA2 (0.66) CA2ALDH1A1L3MBTL1TDP1NPSR1
SCHEMBL13777927 0.84 ALDH1A1 (0.67) CA2ALDH1A1L3MBTL1TDP1NPSR1
SCHEMBL5540004 0.84 ALDH1A1 (0.67) CA2ALDH1A1L3MBTL1TDP1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008077194-A1 RECEPTOR AGONISTS XENOME LTD (AU) 2008-07-03 — — WO claimed
WO-2023164476-A2 COMPOSITIONS AND METHODS FOR TREATING AUTOIMMUNE DISORDERS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2023-08-31 — — WO disclosed
US-20230127357-A1 MIXED MODE CATIONIC EXCHANGE CHROMATOGRAPHY LIGANDS BASED ON SUBSTITUTED 2-BENZAMIDO ACETIC ACID STRUCTURES BIO-RAD LABORATORIES, INC. 2023-04-27 — — US disclosed
US-20230127357-A1 MIXED MODE CATIONIC EXCHANGE CHROMATOGRAPHY LIGANDS BASED ON SUBSTITUTED 2-BENZAMIDO ACETIC ACID STRUCTURES BIO-RAD LABORATORIES, INC. 2023-04-27 — — US disclosed
WO-2023064949-A1 MIXED MODE CATIONIC EXCHANGE CHROMATOGRAPHY LIGANDS BASED ON SUBSTITUTED 2-BENZAMIDO ACETIC ACID STRUCTURES BIO-RAD LABORATORIES, INC. (US) 2023-04-20 — — WO disclosed
EP-1639080-A4 A LIBRARY OF PHYLOGENETICALLY RELATED SEQUENCES COGNETIX INC (US) 2008-10-01 — — EP disclosed
EP-1639080-A2 A LIBRARY OF PHYLOGENETICALLY RELATED SEQUENCES Cognetix, Inc. (US) 2006-03-29 — — EP disclosed
WO-2004108901-A2 A LIBRARY OF PHYLOGENETICALLY RELATED SEQUENCES COGNETIX, INC. (US) 2004-12-16 — — 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-20230127357-A1 MIXED MODE CATIONIC EXCHANGE CHROMATOGRAPHY LIGANDS BASED ON SUBSTITUTED 2-BENZAMIDO ACETIC ACID STRUCTURES SSB, AEBP2, NASP CA2 181/4885ALDH1A1 3112/4885L3MBTL1 3618/4885

“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.

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