SCHEMBL10303451

SCHEMBL10303451

C[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC1CCCCC1)C(N)=O)[C@@H](C)O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 9/20 0.42
▸ NPY5R Q15761 6/20 0.42
▸ NPY1R P25929 6/20 0.42
▸ NPY2R P49146 3/20 0.42
▸ MMP1 P03956 2/20 0.40
▸ MMP2 P08253 2/20 0.40
▸ MMP3 P08254 2/20 0.40
▸ NMT1 P30419 5/20 0.40
▸ NMT2 O60551 4/20 0.40
▸ CPB2 Q96IY4 2/20 0.39

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
SCHEMBL10303436 0.90 NPY4R (0.43) NPY4RNPY5RNPY1RNPY2RMMP1
SCHEMBL10303447 0.90 NPY4R (0.40) NPY4RNPY5RNPY1RNPY2RMMP1
SCHEMBL10303439 0.89 MMP1 (0.42) NPY4RNPY5RNPY1RNPY2RMMP1
SCHEMBL10303440 0.83 NPY2R (0.41) NPY4RNPY5RNPY1RNPY2RMMP1
SCHEMBL12340430 0.82 IL23R (0.37) NPY4RNPY5RNPY1RNPY2RMMP1
SCHEMBL30857468 0.81 MMP1 (0.43) NPY4RNPY5RNPY1RNPY2RMMP1
SCHEMBL30528168 0.80 NPY4R (0.45) NPY4RNPY5RNPY1RNPY2RMMP1
SCHEMBL30658144 0.80 CPB2 (0.47) NPY4RNPY5RNPY1RNPY2RNMT1
Hydrochloric Acid SCHEMBL31021035 0.79 NPY4R (0.44) NPY4RNPY5RNPY1RNPY2RMMP1
Hydrochloric Acid SCHEMBL31021010 0.79 NPY4R (0.48) NPY4RNPY5RNPY1RNPY2RMMP1

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-9260500-B2 Peptide and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-02-16 — — US disclosed
US-20120172293-A1 PEPTIDE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED 2012-07-05 — — 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-20120172293-A1 PEPTIDE AND USE THEREOF GLP1R, GIPR, SCTR NPY4R 4/4885NPY5R 6/4885NPY1R 5/4885

“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