SCHEMBL30180609

SCHEMBL30180609

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

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 3/20 0.59
▸ OPRM1 P35372 2/20 0.59
▸ KISS1R Q969F8 4/20 0.58
▸ ERAP2 Q6P179 3/20 0.56
▸ IL1RN P18510 2/20 0.56
▸ NPY1R P25929 3/20 0.55
▸ NPY2R P49146 3/20 0.55
▸ NPY4R P50391 3/20 0.55
▸ CCKBR P32239 3/20 0.54
▸ CCKAR P32238 1/20 0.54
▸ ERAP1 Q9NZ08 1/20 0.53

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
SCHEMBL30180814 0.93 OPRD1 (0.63) OPRD1OPRM1KISS1RERAP2IL1RN
SCHEMBL30180772 0.89 OPRD1 (0.59) OPRD1OPRM1KISS1RERAP2IL1RN
SCHEMBL30823996 0.89 KISS1R (0.60) OPRD1OPRM1KISS1RERAP2IL1RN
SCHEMBL30567421 0.88 ERAP2 (0.62) OPRD1OPRM1ERAP2IL1RNNPY1R
SCHEMBL31303497 0.87 ERAP2 (0.61) OPRD1OPRM1ERAP2IL1RNNPY1R
SCHEMBL31303469 0.87 ERAP2 (0.61) OPRD1OPRM1ERAP2IL1RNNPY1R
SCHEMBL30772212 0.85 ERAP2 (0.64) OPRD1OPRM1ERAP2IL1RNERAP1
SCHEMBL31276131 0.85 ERAP2 (0.59) OPRD1OPRM1KISS1RERAP2IL1RN
SCHEMBL30054135 0.85 EDNRA (0.58) OPRD1OPRM1ERAP2IL1RNCCKBR
SCHEMBL31064875 0.85 KISS1R (0.55) KISS1RERAP2

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 OPRD1 2406/4885OPRM1 2322/4885KISS1R 3400/4885

“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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