SCHEMBL22692911

SCHEMBL22692911

CNC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCOCCOCCOCCOCCOCCOCCN)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 9/20 0.40
▸ PRSS1 P07477 2/20 0.38
▸ NMT2 O60551 1/20 0.38
▸ NMT1 P30419 1/20 0.38
▸ CTSL P07711 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.35
▸ CHRNA1 P02708 1/20 0.34
▸ CHRNG P07510 1/20 0.34
▸ CHRNB1 P11230 1/20 0.34
▸ CHRND Q07001 1/20 0.34
▸ TLR2 O60603 1/20 0.34
▸ C3AR1 Q16581 1/20 0.34
▸ NPY1R P25929 1/20 0.33
▸ NPY4R P50391 1/20 0.33
▸ SIRT6 Q8N6T7 1/20 0.33
▸ SIRT1 Q96EB6 1/20 0.33

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
SCHEMBL26274813 0.92 FURIN (0.40) FURINPRSS1NMT2NMT1CTSL
SCHEMBL27099847 0.88 FURIN (0.43) FURINPRSS1NMT2NMT1CTSL
SCHEMBL27426472 0.88 FURIN (0.46) FURINPRSS1NMT2NMT1CTSL
SCHEMBL23429029 0.86 HTT (0.41) FURINPRSS1CHRNA1CHRNGCHRNB1
SCHEMBL22138596 0.85 FURIN (0.39) FURINCHRNA1CHRNGCHRNB1CHRND
SCHEMBL22138594 0.85 FURIN (0.39) FURINCHRNA1CHRNGCHRNB1CHRND
SCHEMBL20705515 0.85 FURIN (0.39) FURINCHRNA1CHRNGCHRNB1CHRND
SCHEMBL27447192 0.85 FURIN (0.39) FURINCHRNA1CHRNGCHRNB1CHRND
SCHEMBL26261212 0.84 NOD1 (0.36) FURINPRSS1CTSLRXFP1TLR2
SCHEMBL21297142 0.84 FAP (0.35) FURINPRSS1RXFP1C3AR1NPY1R

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-10842881-B2 Engineered polypeptide conjugates using transglutaminase RINAT NEUROSCIENCE CORP. (US) 2020-11-24 — — 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-10842881-B2 Engineered polypeptide conjugates using transglutaminase TGM2, TGM3, TGM1 FURIN 842/4885PRSS1 1639/4885NMT2 20/4885

“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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