SCHEMBL23346292

SCHEMBL23346292

CC(C)C[C@H](NC(=O)[C@H](CCc1ccc(O)cc1)NC(=O)C(CCCNC(=N)N)NC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@@H](C)CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 19/20 0.57
▸ IL23R Q5VWK5 1/20 0.54

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
SCHEMBL29595208 0.94 KISS1R (0.62) KISS1R
SCHEMBL29595776 0.94 KISS1R (0.62) KISS1R
SCHEMBL30450426 0.93 KISS1R (0.63) KISS1RIL23R
SCHEMBL30675548 0.91 KISS1R (0.64) KISS1R
SCHEMBL30802584 0.90 KISS1R (0.63) KISS1R
SCHEMBL18082492 0.90 KISS1R (0.56) KISS1RIL23R
SCHEMBL19842025 0.89 KISS1R (0.60) KISS1RIL23R
SCHEMBL20376297 0.89 KISS1R (0.60) KISS1RIL23R
SCHEMBL20376152 0.89 KISS1R (0.60) KISS1RIL23R
SCHEMBL19842010 0.89 KISS1R (0.60) KISS1RIL23R

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-20210138090-A1 uPAR targeting peptide for use in peroperative optical imaging of invasive cancer FLUOGUIDE A/S (DK) 2021-05-13 — — 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-20210138090-A1 uPAR targeting peptide for use in peroperative optical imaging of invasive cancer PLAUR, PLAU, PLG KISS1R 1748/4885IL23R 1405/4885

“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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