SCHEMBL14669794

SCHEMBL14669794

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

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NMT1 P30419 10/20 0.44
▸ NMT2 O60551 9/20 0.44
▸ KDM1A O60341 1/20 0.37
▸ TLR2 O60603 1/20 0.36
▸ FURIN P09958 4/20 0.35

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
SCHEMBL16340673 0.96 NMT2 (0.38) NMT1NMT2FURIN
SCHEMBL16340703 0.88 NMT2 (0.37) NMT1NMT2FURIN
SCHEMBL30781971 0.81 NMT1 (0.48) NMT1NMT2KDM1ATLR2FURIN
SCHEMBL16340632 0.80 ACE (0.43) —
SCHEMBL14669796 0.80 NMT2 (0.38) NMT1NMT2FURIN
SCHEMBL16340670 0.80 FOLH1 (0.42) NMT1NMT2FURIN
SCHEMBL14669746 0.79 GNPAT (0.45) FURIN
SCHEMBL14669549 0.79 GNPAT (0.45) FURIN
SCHEMBL20529374 0.77 NMT2 (0.43) NMT1NMT2FURIN
SCHEMBL29727649 0.76 NMT1 (0.52) NMT1NMT2

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-20130029920-A1 Metal Nanoparticles BRIMBLE MARGARET A (NZ) 2013-01-31 — — 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-20130029920-A1 Metal Nanoparticles PSTPIP2, PCNP, ANPEP NMT1 395/4885NMT2 613/4885KDM1A 4684/4885

“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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