SCHEMBL29854496

SCHEMBL29854496

CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCC(N)=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](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 8/20 0.68
▸ NPY4R P50391 8/20 0.68
▸ NPY5R Q15761 8/20 0.68
▸ NPY1R P25929 6/20 0.68
▸ TFPI P10646 3/20 0.62
▸ F2 P00734 4/20 0.61
▸ MC4R P32245 1/20 0.61
▸ CALCR P30988 2/20 0.60

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
SCHEMBL29526997 0.96 NPY2R (0.72) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29496391 0.93 NPY2R (0.72) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29854544 0.92 NPY2R (0.67) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29854567 0.91 NPY2R (0.68) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29496288 0.90 NPY2R (0.74) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29397746 0.90 NPY2R (0.73) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30176412 0.90 MC4R (0.63) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29854495 0.89 NPY2R (0.72) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29571016 0.89 NPY2R (0.70) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30495631 0.88 F2 (0.66) NPY2RNPY4RNPY5RNPY1RF2

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.

Send feedback