SCHEMBL16507850

SCHEMBL16507850

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 2/20 0.47
▸ REN P00797 1/20 0.43
▸ F2 P00734 4/20 0.43
▸ KISS1R Q969F8 2/20 0.43
▸ BACE1 P56817 1/20 0.42
▸ BACE2 Q9Y5Z0 1/20 0.42
▸ CRHR1 P34998 1/20 0.42
▸ CRHR2 Q13324 1/20 0.42
▸ NTSR2 O95665 2/20 0.41
▸ NTSR1 P30989 2/20 0.41
▸ ACE P12821 2/20 0.41
▸ IL23R Q5VWK5 1/20 0.41

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
SCHEMBL16507899 0.95 PTPN1 (0.44) NPY4RRENACE
SCHEMBL16507827 0.89 ACE (0.49) NPY4RRENF2KISS1RACE
SCHEMBL16507942 0.85 ACE (0.39) NPY4RCRHR1CRHR2ACE
SCHEMBL16358940 0.84 ACE (0.38) CRHR1CRHR2ACE
SCHEMBL12045120 0.83 REN (0.41) RENKISS1RBACE1
SCHEMBL29790444 0.82 NPY4R (0.48) NPY4RKISS1R
SCHEMBL31020877 0.82 ACE (0.47) NPY4RKISS1RACE
SCHEMBL8894942 0.81 GLP1R (0.53) KISS1RCRHR1CRHR2IL23R
SCHEMBL16508075 0.81 NPY4R (0.53) NPY4RKISS1RIL23R
SCHEMBL30512722 0.81 BACE1 (0.52) F2BACE1CRHR1CRHR2

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-20110294738-A1 PTHR1 RECEPTOR COMPOUNDS ANTHOR THERAPEUTICS, INC. 2011-12-01 — — 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-20110294738-A1 PTHR1 RECEPTOR COMPOUNDS PTH1R, MC1R, CASR NPY4R 1387/4885REN 525/4885F2 4046/4885

“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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