SCHEMBL24519196

SCHEMBL24519196

CCCCCC(=O)N1CCCC1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 8/20 0.54
▸ ACE2 Q9BYF1 5/20 0.54
▸ OPRD1 P41143 3/20 0.46
▸ OPRM1 P35372 2/20 0.46
▸ BDKRB2 P30411 1/20 0.44
▸ ANPEP P15144 1/20 0.43
▸ LNPEP Q9UIQ6 1/20 0.43
▸ NMUR2 Q9GZQ4 1/20 0.43
▸ NMUR1 Q9HB89 1/20 0.43
▸ NTSR1 P30989 1/20 0.42
▸ PRCP P42785 1/20 0.42
▸ DPP4 P27487 1/20 0.42
▸ AGTR1 P30556 2/20 0.42
▸ AGTR2 P50052 2/20 0.42
▸ ITGB3 P05106 1/20 0.42
▸ ITGA2B P08514 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
SCHEMBL18373946 1.00 ACE (0.54) ACEACE2OPRD1OPRM1BDKRB2
SCHEMBL18373945 0.99 ACE (0.55) ACEACE2OPRD1OPRM1BDKRB2
SCHEMBL28918903 0.99 ACE (0.55) ACEACE2OPRD1OPRM1BDKRB2
SCHEMBL18373913 0.99 ACE (0.55) ACEACE2OPRD1OPRM1BDKRB2
SCHEMBL24519195 0.99 ACE (0.55) ACEACE2OPRD1OPRM1BDKRB2
SCHEMBL18373947 0.99 ACE (0.55) ACEACE2OPRD1OPRM1BDKRB2
SCHEMBL18373953 0.99 ACE (0.55) ACEACE2OPRD1OPRM1BDKRB2
SCHEMBL18374215 0.97 ACE (0.51) ACEACE2OPRD1OPRM1BDKRB2
SCHEMBL28918703 0.97 ACE (0.57) ACEACE2OPRD1OPRM1NMUR2
SCHEMBL21302922 0.97 ACE (0.57) ACEACE2OPRD1OPRM1NMUR2

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-11365215-B2 Method for preventing, improving, or treating inflammatory bowel disease KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2022-06-21 — — 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-11365215-B2 Method for preventing, improving, or treating inflammatory bowel disease SI, NOD2, TNF ACE 1039/4885ACE2 1532/4885OPRD1 2585/4885

“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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