SCHEMBL31433171

SCHEMBL31433171

CC(C)C[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)N[C@H](C(N)=O)[C@@H](C)O)C(C)C)[C@@H](C)O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 6/20 0.49
▸ MAPK8 P45983 1/20 0.48
▸ MAPK9 P45984 1/20 0.48
▸ MAPK10 P53779 1/20 0.48
▸ RAMP3 O60896 4/20 0.47
▸ CALCR P30988 4/20 0.47
▸ APLNR P35414 1/20 0.46
▸ CTSB P07858 1/20 0.45
▸ PLK1 P53350 1/20 0.45
▸ OPRM1 P35372 5/20 0.44
▸ OPRK1 P41145 5/20 0.44
▸ NMUR2 Q9GZQ4 1/20 0.43
▸ NMUR1 Q9HB89 1/20 0.43
▸ STAT3 P40763 1/20 0.43

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
SCHEMBL31433176 0.91 CAPN1 (0.52) CAPN1RAMP3CALCRAPLNRCTSB
SCHEMBL31433275 0.91 CAPN1 (0.52) CAPN1RAMP3CALCRAPLNRCTSB
SCHEMBL31433337 0.87 RAMP3 (0.55) MAPK8MAPK9MAPK10RAMP3CALCR
SCHEMBL29421104 0.87 RAMP3 (0.49) CAPN1RAMP3CALCRAPLNRPLK1
SCHEMBL29421085 0.87 RAMP3 (0.49) CAPN1RAMP3CALCRAPLNRPLK1
SCHEMBL31433316 0.87 CAPN1 (0.61) CAPN1APLNRCTSB
SCHEMBL29611971 0.87 CAPN1 (0.54) CAPN1MAPK8MAPK9MAPK10RAMP3
SCHEMBL31433339 0.86 MAPK8 (0.51) MAPK8MAPK9MAPK10RAMP3CALCR
SCHEMBL31433220 0.85 RAMP3 (0.52) MAPK8MAPK9MAPK10RAMP3CALCR
SCHEMBL31433313 0.85 MAPK8 (0.55) MAPK8MAPK9MAPK10RAMP3CALCR

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 CAPN1 3160/4885MAPK8 4358/4885MAPK9 3139/4885

“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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