SCHEMBL30180741

SCHEMBL30180741

C[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 1/20 0.61
▸ IL1RN P18510 1/20 0.59
▸ ERAP2 Q6P179 1/20 0.59
▸ OPRD1 P41143 3/20 0.58
▸ OPRM1 P35372 2/20 0.58
▸ CCKBR P32239 6/20 0.57
▸ CCKAR P32238 1/20 0.55

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
SCHEMBL31609332 0.95 ERAP2 (0.63) GHSRIL1RNERAP2CCKBR
SCHEMBL30180812 0.93 IL1RN (0.58) GHSRIL1RNERAP2OPRD1OPRM1
SCHEMBL30180772 0.92 OPRD1 (0.59) GHSRIL1RNERAP2OPRD1OPRM1
SCHEMBL29993798 0.92 OPRD1 (0.65) GHSRIL1RNERAP2OPRD1OPRM1
SCHEMBL30123487 0.89 OPRM1 (0.59) IL1RNERAP2OPRD1OPRM1
SCHEMBL30988893 0.89 ACE (0.61) GHSRERAP2
SCHEMBL29199418 0.89 ERAP2 (0.68) GHSRIL1RNERAP2OPRD1OPRM1
SCHEMBL29199429 0.89 ERAP2 (0.68) GHSRIL1RNERAP2OPRD1OPRM1
SCHEMBL31483375 0.88 GHSR (0.64) GHSRERAP2
SCHEMBL29362220 0.88 OPRM1 (0.59) IL1RNERAP2OPRD1OPRM1

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-20230046728-A1 TECHNOLOGIES USEFUL FOR ASSESSING PERMEABILITY PARABILIS MEDICINES, INC. 2023-02-16 — — 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-20230046728-A1 TECHNOLOGIES USEFUL FOR ASSESSING PERMEABILITY SLC47A2, EPCAM, SLC47A1 GHSR 4042/4885IL1RN 4622/4885ERAP2 50/4885

“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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