SCHEMBL22503733

SCHEMBL22503733

CSCC[C@H](N)C(=O)NC(CCCc1ccc(F)cc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 10/20 0.57
FNTB P49356 10/20 0.57
PGGT1B P53609 10/20 0.57
ALDH1A1 P00352 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HTT P42858 1/20 0.44

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
SCHEMBL23029739 0.89 FOLH1 (0.46) FNTAFNTBPGGT1B
SCHEMBL22503797 0.88 FOLH1 (0.46) FNTAFNTBPGGT1B
SCHEMBL22503722 0.88 FNTA (0.48) FNTAFNTBPGGT1BALDH1A1NPSR1
SCHEMBL20540522 0.87 FNTA (0.60) FNTAFNTBPGGT1BALDH1A1
SCHEMBL23029711 0.87 FNTA (0.46) FNTAFNTBPGGT1B
SCHEMBL20540520 0.87 FNTA (0.60) FNTAFNTBPGGT1BALDH1A1
SCHEMBL22503726 0.87 FNTA (0.49) FNTAFNTBPGGT1B
SCHEMBL22503718 0.86 SPHK1 (0.46) FNTAFNTBPGGT1B
SCHEMBL22503709 0.84 FOLH1 (0.45) FNTAFNTBPGGT1B
SCHEMBL22503661 0.84 NPY1R (0.47) FNTAFNTBPGGT1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210054025-A1 ANTIMICROBIAL COMPOUNDS AND/OR MODULATORS OF MICROBIAL INFECTIONS AND METHODS OF USING THE SAME UNIV INDIANA RES & TECH CORP (US) 2021-02-25 US disclosed
US-10793594-B2 Antimicrobial compounds and/or modulators of microbial infections and methods of using the same INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2020-10-06 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 (2 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-10793594-B2 Antimicrobial compounds and/or modulators of microbial infections and methods of using the same CD47, CGAS, FPR1 FNTA 439/4885FNTB 472/4885PGGT1B 827/4885
US-20210054025-A1 ANTIMICROBIAL COMPOUNDS AND/OR MODULATORS OF MICROBIAL INFECTIONS AND METHODS OF USING THE SAME CD47, CGAS, FPR1 FNTA 439/4885FNTB 472/4885PGGT1B 827/4885

“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.