SCHEMBL29854544

SCHEMBL29854544

CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 10/20 0.67
▸ NPY4R P50391 8/20 0.67
▸ NPY5R Q15761 8/20 0.67
▸ NPY1R P25929 8/20 0.67
▸ TFPI P10646 4/20 0.60
▸ RAMP3 O60896 1/20 0.58
▸ CALCR P30988 1/20 0.58
▸ NMUR2 Q9GZQ4 1/20 0.58
▸ NMUR1 Q9HB89 1/20 0.58
▸ CXCR4 P61073 2/20 0.58
▸ EPHA2 P29317 1/20 0.57

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
SCHEMBL29854567 0.99 NPY2R (0.68) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29854478 0.95 NPY2R (0.70) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29854495 0.94 NPY2R (0.72) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29854496 0.92 NPY2R (0.68) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29527200 0.92 NPY2R (0.79) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29854466 0.90 NPY2R (0.79) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30842181 0.89 NMUR2 (0.64) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31121841 0.89 NMUR2 (0.68) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29854535 0.89 NPY2R (0.60) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29854880 0.89 NPY2R (0.60) NPY2RNPY4RNPY5RNPY1RTFPI

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-20220257719-A1 APPETITE SUPPRESSING COMPOUNDS IP2IPO INNOVATIONS LIMITED (GB) 2022-08-18 — — 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-20220257719-A1 APPETITE SUPPRESSING COMPOUNDS GIPR, GPR119, IAPP NPY2R 8/4885NPY4R 6/4885NPY5R 10/4885

“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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