SCHEMBL22674899

SCHEMBL22674899

C[C@H](NC(=O)CNC(=O)CN)C(=O)N[C@@H](CCCCN)C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 8/20 0.42
▸ NMT2 O60551 1/20 0.40
▸ NMT1 P30419 1/20 0.40
▸ TLR2 O60603 1/20 0.40
▸ QRFPR Q96P65 3/20 0.39
▸ SIRT6 Q8N6T7 1/20 0.38
▸ SIRT1 Q96EB6 1/20 0.38
▸ NOD1 Q9Y239 1/20 0.38
▸ ERAP2 Q6P179 1/20 0.37
▸ ERAP1 Q9NZ08 1/20 0.37
▸ LNPEP Q9UIQ6 1/20 0.37

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
SCHEMBL1352085 0.87 HPGDS (0.43) NMT2NMT1TLR2QRFPRSIRT6
SCHEMBL2159831 0.86 HPGDS (0.42) NMT2NMT1TLR2QRFPRSIRT6
SCHEMBL22133062 0.86 HPGDS (0.42) NMT2NMT1TLR2QRFPRSIRT6
SCHEMBL15302247 0.86 HPGDS (0.42) NMT2NMT1TLR2QRFPRSIRT6
SCHEMBL22674900 0.84 ITGB3 (0.39) FURINTLR2
SCHEMBL30435754 0.83 NOD1 (0.46) FURINNMT2NMT1TLR2SIRT6
SCHEMBL30830406 0.82 NMT2 (0.44) FURINNMT2NMT1QRFPRSIRT6
SCHEMBL29533919 0.81 NPY5R (0.42) FURINNMT2NMT1QRFPR
SCHEMBL29521437 0.81 EGFR (0.43) FURINNMT2NMT1
SCHEMBL30398536 0.81 QRFPR (0.42) NMT2NMT1TLR2QRFPR

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-20200361987-A1 DEUTERATED TETRAPEPTIDES THAT TARGET MITOCHONDRIA STEALTH BIOTHERAPEUTICS INC. 2020-11-19 — — 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-20200361987-A1 DEUTERATED TETRAPEPTIDES THAT TARGET MITOCHONDRIA ABAT, SSBP1, PDF FURIN 2315/4885NMT2 392/4885NMT1 316/4885

“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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