SCHEMBL30632040

SCHEMBL30632040

CC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 6/20 0.40
▸ BACE1 P56817 1/20 0.40
▸ SLC15A2 Q16348 1/20 0.39
▸ FOLH1 Q04609 1/20 0.39
▸ SIRT2 Q8IXJ6 1/20 0.39
▸ SIRT5 Q9NXA8 1/20 0.39
▸ RAMP3 O60896 2/20 0.38
▸ CALCR P30988 2/20 0.38
▸ OPRL1 P41146 1/20 0.38

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
SCHEMBL31265393 0.90 SLC15A2 (0.45) SLC15A2FOLH1
SCHEMBL30632042 0.89 BACE1 (0.40) BACE1
SCHEMBL29381521 0.88 BACE1 (0.40) BACE1SLC15A2FOLH1
SCHEMBL29478145 0.88 SLC15A2 (0.40) BACE1SLC15A2FOLH1
SCHEMBL30974298 0.88 FOLH1 (0.42) BACE1SLC15A2FOLH1
SCHEMBL29557424 0.88 SLC15A2 (0.43) SLC15A2FOLH1
SCHEMBL30512656 0.87 BACE1 (0.45) BACE1
SCHEMBL21766761 0.87 BACE1 (0.41) BACE1SIRT2SIRT5
SCHEMBL29799996 0.86 SLC15A2 (0.44) SLC15A2
SCHEMBL30974127 0.86 GLP1R (0.44) BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11771774-B2 Nerve labeling compositions and uses thereof AVELAS ACQUISITION CORPORATION (US) 2023-10-03 — — 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-11771774-B2 Nerve labeling compositions and uses thereof GAP43, NGF, PMP22 FURIN 1272/4885BACE1 787/4885SLC15A2 1905/4885

“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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