SCHEMBL31433226

SCHEMBL31433226

CC(C)C[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 1/20 0.48
▸ IL23R Q5VWK5 4/20 0.44
▸ FURIN P09958 2/20 0.43
▸ RAMP3 O60896 3/20 0.43
▸ CALCR P30988 3/20 0.43
▸ RXFP1 Q9HBX9 2/20 0.43
▸ PRSS1 P07477 1/20 0.43
▸ PRMT1 Q99873 1/20 0.42
▸ NMT2 O60551 1/20 0.42
▸ NMT1 P30419 1/20 0.42

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
SCHEMBL31433320 0.93 FURIN (0.45) TFPIFURINPRSS1NMT2NMT1
SCHEMBL31433335 0.91 IL23R (0.48) IL23RRAMP3CALCR
SCHEMBL30483687 0.89 NPY4R (0.46) TFPIIL23RFURIN
SCHEMBL30818414 0.88 TFPI (0.50) TFPIIL23RRAMP3CALCR
SCHEMBL31433357 0.88 TFPI (0.54) TFPIIL23R
SCHEMBL31433300 0.88 NPY4R (0.45) TFPI
SCHEMBL31433260 0.87 RAMP3 (0.55) RAMP3CALCR
SCHEMBL31433268 0.87 RAMP3 (0.55) RAMP3CALCR
SCHEMBL30569208 0.85 TFPI (0.59) TFPIIL23R
SCHEMBL29455880 0.84 TFPI (0.53) TFPIIL23RRXFP1

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-20250074942-A1 COMPOSITIONS AND METHODS FOR COVALENT PEPTIDE-BASED MODULATORS OF HLA-E CALICO LIFE SCIENCES LLC (US) 2025-03-06 — — 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-20250074942-A1 COMPOSITIONS AND METHODS FOR COVALENT PEPTIDE-BASED MODULATORS OF HLA-E MICA, CD74, HLA-DRB1 TFPI 2582/4885IL23R 710/4885FURIN 1283/4885

“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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