SCHEMBL30259946

SCHEMBL30259946

N=C(N)NCCCC[C@H](NC(=O)[C@H](Cc1ccc(-c2ccccc2)cc1)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 5/20 0.51
▸ NPY1R P25929 3/20 0.51
▸ NPY2R P49146 3/20 0.51
▸ NPY4R P50391 3/20 0.51
▸ KISS1R Q969F8 2/20 0.49
▸ OPRM1 P35372 1/20 0.49
▸ OPRD1 P41143 1/20 0.49
▸ NPBWR1 P48145 1/20 0.49

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
SCHEMBL30390841 0.94 NPY4R (0.58) NPY1RNPY2RNPY4RKISS1ROPRM1
SCHEMBL31206184 0.93 KISS1R (0.55) GHSRKISS1ROPRM1OPRD1
SCHEMBL30259958 0.93 GHSR (0.55) GHSRNPY1RNPY2RNPY4RKISS1R
SCHEMBL30451792 0.92 NPBWR1 (0.52) GHSRNPY1RNPY2RNPY4RKISS1R
SCHEMBL30669192 0.92 NPY1R (0.57) NPY1RNPY2RNPY4RKISS1ROPRM1
SCHEMBL31073545 0.92 GHSR (0.55) GHSRNPBWR1
SCHEMBL30839329 0.91 KDM4E (0.53) GHSRKISS1R
SCHEMBL30919241 0.90 KISS1R (0.55) GHSRNPY1RNPY2RNPY4RKISS1R
SCHEMBL30919236 0.90 KISS1R (0.55) GHSRNPY1RNPY2RNPY4RKISS1R
SCHEMBL29799999 0.90 KDM4E (0.52) GHSRNPY1RNPY2RNPY4RKISS1R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230203096-A1 EPHA4 TARGETING COMPOUNDS AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-29 — — US disclosed
EP-4139326-A1 EPHA4 TARGETING COMPOUNDS AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-03-01 — — EP 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-20230203096-A1 EPHA4 TARGETING COMPOUNDS AND METHODS OF USE THEREOF EPHA4, EPHA1, EPHA5 GHSR 4150/4885NPY1R 2313/4885NPY2R 2482/4885

“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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