SCHEMBL30455824

SCHEMBL30455824

CC[C@H](C)[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 1/20 0.57
▸ MAPK9 P45984 1/20 0.57
▸ MAPK10 P53779 1/20 0.57
▸ CALCR P30988 6/20 0.57
▸ APLNR P35414 1/20 0.56
▸ KEAP1 Q14145 3/20 0.55
▸ F2 P00734 4/20 0.54
▸ MC4R P32245 1/20 0.52
▸ HCRTR1 O43613 1/20 0.51
▸ HCRTR2 O43614 1/20 0.51
▸ RAMP3 O60896 2/20 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
SCHEMBL29416061 0.89 MAPK8 (0.63) MAPK8MAPK9MAPK10CALCRAPLNR
SCHEMBL38662088 0.87 APLNR (0.63) MAPK8MAPK9MAPK10CALCRAPLNR
SCHEMBL30455558 0.87 APLNR (0.62) CALCRAPLNRKEAP1MC4RRAMP3
SCHEMBL29678024 0.86 OPRM1 (0.58) CALCRAPLNRMC4R
SCHEMBL30272472 0.86 APLNR (0.57) MAPK8MAPK9MAPK10CALCRAPLNR
SCHEMBL31691514 0.85 APLNR (0.62) MAPK8MAPK9MAPK10CALCRAPLNR
SCHEMBL31182889 0.85 MAPK8 (0.68) MAPK8MAPK9MAPK10CALCRAPLNR
SCHEMBL29822539 0.85 F2 (0.62) MAPK8MAPK9MAPK10CALCRAPLNR
SCHEMBL31558595 0.85 F2 (0.58) MAPK8MAPK9MAPK10CALCRAPLNR
SCHEMBL31558553 0.85 F2 (0.58) MAPK8MAPK9MAPK10CALCRAPLNR

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-20230193291-A1 METHOD FOR PRODUCING BLOCKPOYMERS BY MEANS OF LINKING BLOCKS BY A TRANSPEPTIDASE, AND BLOCK POLYMERS OBTAINED BY TRANSPEPTIDASE LINKING FRAUNHOFER GES FORSCHUNG (DE) 2023-06-22 — — 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-20230193291-A1 METHOD FOR PRODUCING BLOCKPOYMERS BY MEANS OF LINKING BLOCKS BY A TRANSPEPTIDASE, AND BLOCK POLYMERS OBTAINED BY TRANSPEPTIDASE LINKING RNPEP, DNPEP, ENPEP MAPK8 3571/4885MAPK9 4028/4885MAPK10 4216/4885

“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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