SCHEMBL31433201

SCHEMBL31433201

CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(N)=O

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 4/20 0.59
▸ CALCR P30988 4/20 0.58
▸ HCRTR1 O43613 1/20 0.55
▸ HCRTR2 O43614 1/20 0.55
▸ OPRD1 P41143 4/20 0.53
▸ CCKBR P32239 2/20 0.52
▸ GLP1R P43220 2/20 0.52
▸ OPRM1 P35372 1/20 0.51
▸ CRHR1 P34998 1/20 0.51
▸ CRHR2 Q13324 1/20 0.51

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
SCHEMBL2448693 0.87 CALCR (0.71) F2CALCRHCRTR1HCRTR2CCKBR
SCHEMBL31453812 0.86 F2 (0.67) F2CALCRHCRTR1HCRTR2CCKBR
SCHEMBL31453815 0.86 F2 (0.67) F2CALCRHCRTR1HCRTR2CCKBR
SCHEMBL30431706 0.85 CALCR (0.66) F2CALCRHCRTR1HCRTR2CCKBR
SCHEMBL29812479 0.85 CALCR (0.66) F2CALCRHCRTR1HCRTR2CCKBR
SCHEMBL30974240 0.85 F2 (0.58) F2CALCRHCRTR1HCRTR2OPRD1
SCHEMBL29903351 0.85 CALCR (0.71) F2CALCRHCRTR1HCRTR2CCKBR
SCHEMBL30726594 0.84 CALCR (0.73) F2CALCRHCRTR1HCRTR2CCKBR
SCHEMBL30974376 0.84 F2 (0.58) F2CALCRHCRTR1HCRTR2OPRD1
SCHEMBL29942474 0.83 CALCR (0.68) F2CALCRHCRTR1HCRTR2CCKBR

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 F2 2732/4885CALCR 2817/4885HCRTR1 3997/4885

“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.

Send feedback