SCHEMBL4534760

SCHEMBL4534760

NC[C@H](NCc1ccc(C#Cc2ccccc2)cc1)C(=O)NO

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.45
MEP1B Q16820 2/20 0.45
FFAR4 Q5NUL3 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
SCHEMBL405951 0.95 MEP1B (0.43) MEP1B
SCHEMBL404744 0.86 MEP1B (0.49) MEP1B
SCHEMBL403331 0.82 MEP1B (0.46) MEP1B
SCHEMBL403330 0.82 MEP1B (0.46) MEP1B
SCHEMBL4915096 0.81 BCHE (0.51)
SCHEMBL4915087 0.81 BCHE (0.51)
SCHEMBL2876201 0.80 ANPEP (0.42) MEP1B
SCHEMBL2876198 0.80 ANPEP (0.42) MEP1B
SCHEMBL403730 0.79 HDAC8 (0.54)
SCHEMBL403760 0.79 ACACB (0.45)

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-8084615-B2 Antibacterial agents UNIVERSITY OF WASHINGTON (US) 2011-12-27 US disclosed
US-20090163496-A1 ANTIBACTERIAL AGENTS UNIVERSITY OF WASHINGTON (US) 2009-06-25 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 (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-20090163496-A1 ANTIBACTERIAL AGENTS MRPL21, SI, PGLS FFAR1 1540/4885MEP1B 1047/4885FFAR4 1857/4885

“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.