SCHEMBL4082389

SCHEMBL4082389

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nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OR51E2 Q9H255 2/20 0.33
GLRA1 P23415 1/20 0.33
SLC6A9 P48067 1/20 0.33
GAA P10253 1/20 0.33
SLC1A1 P43005 1/20 0.31
USP2 O75604 1/20 0.30
SLCO1B1 Q9Y6L6 1/20 0.30
GABRR1 P24046 2/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL15756799 1.00 OR51E2 (0.33) OR51E2GLRA1SLC6A9GAASLC1A1
SCHEMBL8960944 0.82 FFAR4 (0.39) OR51E2
SCHEMBL3396664 0.80 SLC7A5 (0.39) GAASLC1A1USP2SLCO1B1
SCHEMBL29349420 0.80 PTGS1 (0.39) OR51E2GLRA1SLC6A9
SCHEMBL7790458 0.80 PTGS1 (0.39) OR51E2GLRA1SLC6A9
SCHEMBL15756829 0.80 GABRR1 (0.38) OR51E2GLRA1SLC6A9GABRR1LMNA
SCHEMBL2950122 0.78 DPP4 (0.33) GAA
SCHEMBL4097963 0.78 USP2 (0.32) USP2SLCO1B1
SCHEMBL15757064 0.77 SLC7A5 (0.43) GAASLC1A1GABRR1LMNA
SCHEMBL4299640 0.75 GSR (0.48) GABRR1LMNA

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-8076285-B2 Lysobactin amides AICURIS GMBH & CO. KG (DE) 2011-12-13 US disclosed
US-20090203582-A1 LYSOBACTIN AMIDES BAYER HEALTHCARE AG (DE) 2009-08-13 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-20090203582-A1 LYSOBACTIN AMIDES AADAT, HAMP, DLST OR51E2 4134/4885GLRA1 1306/4885SLC6A9 1098/4885

“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.