SCHEMBL29387152

SCHEMBL29387152

C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NMT1 P30419 4/20 0.45
▸ NMT2 O60551 3/20 0.45
▸ FOLH1 Q04609 1/20 0.43
▸ TLR2 O60603 1/20 0.42
▸ BACE1 P56817 2/20 0.41
▸ NOD1 Q9Y239 1/20 0.40
▸ OPRL1 P41146 1/20 0.40
▸ GRIN2D O15399 1/20 0.40
▸ GRIN3B O60391 1/20 0.40
▸ GRIN1 Q05586 1/20 0.40
▸ GRIN2A Q12879 1/20 0.40
▸ GRIN2B Q13224 1/20 0.40
▸ GRIN2C Q14957 1/20 0.40
▸ GRIN3A Q8TCU5 1/20 0.40
▸ CPB2 Q96IY4 2/20 0.39

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
SCHEMBL31593295 0.90 NMT1 (0.45) NMT1NMT2FOLH1TLR2BACE1
SCHEMBL29474447 0.90 FOLH1 (0.49) NMT1NMT2FOLH1TLR2BACE1
SCHEMBL30734094 0.89 FOLH1 (0.48) NMT1NMT2FOLH1BACE1NOD1
SCHEMBL29777885 0.89 FOLH1 (0.48) NMT1NMT2FOLH1BACE1NOD1
SCHEMBL29960118 0.89 FOLH1 (0.46) FOLH1BACE1NOD1CPB2
SCHEMBL30376537 0.88 ERAP2 (0.48) NMT1NMT2FOLH1BACE1NOD1
SCHEMBL11697730 0.87 NMT1 (0.48) NMT1NMT2FOLH1TLR2BACE1
SCHEMBL29591503 0.87 NMT1 (0.49) NMT1NMT2FOLH1TLR2CPB2
SCHEMBL29777768 0.86 FOLH1 (0.54) FOLH1BACE1NOD1CPB2
SCHEMBL30578573 0.86 FOLH1 (0.54) FOLH1BACE1NOD1CPB2

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-20220047698-A1 SYNTHETIC INNATE IMMUNE RECEPTOR LIGANDS AND USES THEREOF ALBERTA RES CHEMICALS INC (CA) 2022-02-17 — — 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-20220047698-A1 SYNTHETIC INNATE IMMUNE RECEPTOR LIGANDS AND USES THEREOF TLR3, TLR4, TLR9 NMT1 1051/4885NMT2 1254/4885FOLH1 1870/4885

“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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