SCHEMBL30180772

SCHEMBL30180772

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](CCC(N)=O)C(=O)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
▸ CCKBR P32239 10/20 0.58
▸ NPY1R P25929 3/20 0.56
▸ NPY2R P49146 3/20 0.56
▸ NPY4R P50391 3/20 0.56
▸ CCKAR P32238 1/20 0.56
▸ IL1RN P18510 1/20 0.56
▸ ERAP2 Q6P179 1/20 0.56
▸ GHSR Q92847 1/20 0.55
▸ KISS1R Q969F8 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
SCHEMBL30180814 0.93 OPRD1 (0.63) OPRD1OPRM1CCKBRNPY1RNPY2R
SCHEMBL30180741 0.92 GHSR (0.61) OPRD1OPRM1CCKBRCCKARIL1RN
SCHEMBL30567443 0.91 NPY1R (0.62) NPY1RNPY2RNPY4RIL1RNERAP2
SCHEMBL30772212 0.91 ERAP2 (0.64) OPRD1OPRM1IL1RNERAP2
SCHEMBL30180812 0.90 IL1RN (0.58) OPRD1OPRM1CCKBRCCKARIL1RN
SCHEMBL30799516 0.90 CCKBR (0.57) OPRD1CCKBRCCKARERAP2GHSR
SCHEMBL30799856 0.90 CCKBR (0.57) OPRD1CCKBRCCKARERAP2GHSR
SCHEMBL30219046 0.90 ERAP2 (0.68) IL1RNERAP2KISS1R
SCHEMBL30123487 0.90 OPRM1 (0.59) OPRD1OPRM1NPY1RNPY2RNPY4R
SCHEMBL17877082 0.90 ERAP2 (0.57) NPY1RNPY2RNPY4RIL1RNERAP2

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 2322/4885CCKBR 1066/4885

“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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