SCHEMBL22503598

SCHEMBL22503598

NC(Cc1ccc(F)cc1)C(=O)NC(Cc1ccc(F)c(F)c1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 6/20 0.50
▸ ACE P12821 4/20 0.50
▸ CPA1 P15085 3/20 0.50
▸ ACE2 Q9BYF1 3/20 0.50
▸ ALDH1A1 P00352 1/20 0.49
▸ CA2 P00918 1/20 0.48
▸ MC4R P32245 1/20 0.46
▸ MC3R P41968 1/20 0.46
▸ GPR34 Q9UPC5 2/20 0.46
▸ YARS1 P54577 1/20 0.43

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
SCHEMBL22503735 1.00 MME (0.50) MMEACECPA1ACE2ALDH1A1
SCHEMBL20541056 1.00 MME (0.50) MMEACECPA1ACE2ALDH1A1
SCHEMBL20540754 0.93 MME (0.52) MMEACECPA1ACE2ALDH1A1
SCHEMBL22503737 0.93 MME (0.52) MMEACECPA1ACE2ALDH1A1
SCHEMBL22503596 0.93 MME (0.52) MMEACECPA1ACE2ALDH1A1
SCHEMBL23029818 0.91 MME (0.59) MMEACECPA1ACE2YARS1
SCHEMBL22503576 0.91 MME (0.59) MMEACECPA1ACE2YARS1
SCHEMBL20540699 0.91 MME (0.59) MMEACECPA1ACE2YARS1
SCHEMBL22503611 0.91 ALDH1A1 (0.57) MMEACECPA1ACE2ALDH1A1
SCHEMBL30838090 0.91 ALDH1A1 (0.57) MMEACECPA1ACE2ALDH1A1

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 MME 150/4885ACE 692/4885CPA1 934/4885
US-20210054025-A1 ANTIMICROBIAL COMPOUNDS AND/OR MODULATORS OF MICROBIAL INFECTIONS AND METHODS OF USING THE SAME CD47, CGAS, FPR1 MME 150/4885ACE 692/4885CPA1 934/4885

“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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