SCHEMBL30179445

SCHEMBL30179445

CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 1/20 0.48
▸ MC4R P32245 4/20 0.47
▸ PTPN2 P17706 1/20 0.47
▸ PTPN1 P18031 1/20 0.47
▸ IL23R Q5VWK5 7/20 0.47
▸ NMUR2 Q9GZQ4 1/20 0.47
▸ NMUR1 Q9HB89 1/20 0.47
▸ FOLH1 Q04609 1/20 0.46
▸ OPRL1 P41146 1/20 0.45
▸ GNPAT O15228 1/20 0.45
▸ NPBWR1 P48145 1/20 0.45

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
SCHEMBL30179308 1.00 TFPI (0.48) TFPIMC4RPTPN2PTPN1IL23R
SCHEMBL30179150 1.00 TFPI (0.48) TFPIMC4RPTPN2PTPN1IL23R
SCHEMBL30179352 1.00 TFPI (0.48) TFPIMC4RPTPN2PTPN1IL23R
SCHEMBL30179134 0.92 GNPAT (0.52) MC4RPTPN2PTPN1FOLH1GNPAT
SCHEMBL30029024 0.89 GNPAT (0.56) MC4RFOLH1GNPAT
SCHEMBL13388052 0.86 NPY4R (0.58) TFPIIL23RNMUR2NMUR1NPBWR1
SCHEMBL29569028 0.84 GNPAT (0.62) PTPN2PTPN1GNPAT
SCHEMBL31298941 0.84 QRFPR (0.55) TFPIOPRL1GNPATNPBWR1
SCHEMBL29568898 0.84 OPRL1 (0.50) OPRL1
SCHEMBL29569472 0.84 OPRL1 (0.50) OPRL1

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-20230041271-A1 Mitochondria-Targeted Polypeptide, Preparation Method thereof, and Use thereof SUN YAT-SEN UNIVERSITY (CN) 2023-02-09 — — 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-20230041271-A1 Mitochondria-Targeted Polypeptide, Preparation Method thereof, and Use thereof MTPN, TIMM13, TIMM10 TFPI 2430/4885MC4R 819/4885PTPN2 1557/4885

“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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