SCHEMBL30788334

SCHEMBL30788334

N=C(N)NCCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 3/20 0.51
▸ MC4R P32245 1/20 0.49
▸ APLNR P35414 3/20 0.49
▸ CTSL P07711 3/20 0.48
▸ CTSS P25774 3/20 0.48
▸ CTSK P43235 3/20 0.48
▸ CTSH P09668 1/20 0.48
▸ MAOB P27338 1/20 0.47
▸ KDM5A P29375 1/20 0.47
▸ KDM1B Q8NB78 1/20 0.47
▸ GHSR Q92847 3/20 0.47
▸ C5AR1 P21730 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
SCHEMBL29608138 0.91 APLNR (0.49) KDM1AAPLNRC5AR1
SCHEMBL29606988 0.89 C5AR1 (0.51) KDM1AAPLNRMAOBKDM5AKDM1B
SCHEMBL31696335 0.85 KDM1A (0.54) KDM1AMAOBKDM5AKDM1B
SCHEMBL29607547 0.84 REN (0.53) KDM1AAPLNRMAOBKDM5AKDM1B
SCHEMBL29551839 0.84 APLNR (0.55) MC4RAPLNRCTSLCTSSCTSK
SCHEMBL31256950 0.83 CTSL (0.51) MC4RAPLNRCTSLCTSSCTSK
SCHEMBL29607931 0.82 C5AR1 (0.55) MC4RAPLNRCTSLCTSSCTSK
SCHEMBL29607221 0.82 C5AR1 (0.53) MC4RAPLNRCTSLCTSSCTSK
SCHEMBL3215690 0.82 MAPK8 (0.51) KDM1AMAOBKDM5AKDM1B
SCHEMBL30844390 0.82 MAPK8 (0.54) KDM1AMAOBKDM5AKDM1B

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-20240076314-A1 PEPTIDE COMPOSITIONS AND METHODS FOR INHIBITING NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY GLO PHARMA, INC. 2024-03-07 — — 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-20240076314-A1 PEPTIDE COMPOSITIONS AND METHODS FOR INHIBITING NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY CHRNB1, CHRNG, CHRNA1 KDM1A 2481/4885MC4R 101/4885APLNR 46/4885

“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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