SCHEMBL2195159

SCHEMBL2195159

CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
XIAP P98170 1/20 0.54
NTSR2 O95665 18/20 0.53
NTSR1 P30989 18/20 0.53
SORT1 Q99523 17/20 0.53

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
SCHEMBL2195145 0.94 XIAP (0.55) XIAPNTSR2NTSR1SORT1
SCHEMBL31084988 0.88 NTSR2 (0.56) XIAPNTSR2NTSR1SORT1
SCHEMBL30311236 0.85 XIAP (0.48) XIAPNTSR2NTSR1SORT1
SCHEMBL30874709 0.85 XIAP (0.53) XIAPNTSR2NTSR1SORT1
SCHEMBL31385448 0.85 NTSR2 (0.47) XIAPNTSR2NTSR1SORT1
SCHEMBL29470192 0.85 ACE (0.50) XIAPNTSR2NTSR1SORT1
SCHEMBL30853507 0.84 XIAP (0.48) XIAPNTSR2NTSR1SORT1
SCHEMBL31289489 0.84 XIAP (0.52) XIAPNTSR2NTSR1SORT1
SCHEMBL29572637 0.84 DPP4 (0.47) XIAPNTSR2NTSR1SORT1
Acetic Acid SCHEMBL30311279 0.84 ELANE (0.47) XIAPNTSR2NTSR1SORT1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190070251-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS 2019-03-07 US disclosed
US-9682153-B2 Polymer conjugates of therapeutic peptides NEKTAR THERAPEUTICS (US) 2017-06-20 US disclosed
US-20160022828-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS 2016-01-28 US disclosed
US-20110171312-A1 MODIFIED THERAPEUTIC PEPTIDES, METHODS OF THEIR PREPARATION AND USE NEKTAR THERAPEUTICS (US) 2011-07-14 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 (3 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-20160022828-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP XIAP 264/4885NTSR2 441/4885NTSR1 259/4885
US-20190070251-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP XIAP 264/4885NTSR2 441/4885NTSR1 259/4885
US-20110171312-A1 MODIFIED THERAPEUTIC PEPTIDES, METHODS OF THEIR PREPARATION AND USE DNPEP, VIP, PTMS XIAP 443/4885NTSR2 582/4885NTSR1 336/4885

“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.