SCHEMBL18659577

SCHEMBL18659577

CC(C)(C)OC(=O)N[C@H](CCCN/C(=N\C(=O)OCc1ccccc1)NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCNC(=O)OCc1ccccc1)C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.53
▸ KLK7 P49862 3/20 0.52
▸ KLK5 Q9Y337 3/20 0.52
▸ MAPT P10636 1/20 0.49
▸ CCKBR P32239 3/20 0.48
▸ PSMB8 P28062 1/20 0.47
▸ PSMB9 P28065 1/20 0.47
▸ PSMB5 P28074 1/20 0.47
▸ REN P00797 2/20 0.47
▸ SIRT2 Q8IXJ6 1/20 0.47
▸ ITGB3 P05106 1/20 0.46
▸ ITGA2B P08514 1/20 0.46

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
SCHEMBL18659587 0.94 CTSL (0.47) CTSLKLK7KLK5MAPTCCKBR
SCHEMBL18659589 0.93 KLK7 (0.46) CTSLKLK7KLK5MAPTCCKBR
SCHEMBL17073778 0.90 CTSL (0.64) CTSLKLK7KLK5MAPTCCKBR
SCHEMBL18659557 0.89 CTSL (0.55) CTSLSIRT2
SCHEMBL18659583 0.89 CTSL (0.51) CTSLRENSIRT2
SCHEMBL17073796 0.88 CTSL (0.56) CTSLSIRT2
SCHEMBL16869898 0.88 MAPT (0.59) CTSLKLK7KLK5MAPTCCKBR
SCHEMBL31679023 0.88 CTSL (0.57) CTSLKLK7KLK5MAPTCCKBR
SCHEMBL17073813 0.87 CTSL (0.52) CTSLSIRT2
SCHEMBL17073798 0.87 CTSL (0.52) CTSLSIRT2

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-20170081363-A1 PHARMACEUTICALLY RELEVANT AROMATIC-CATIONIC PEPTIDES STEALTH BIOTHERAPEUTICS CORP (MC) 2017-03-23 — — 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-20170081363-A1 PHARMACEUTICALLY RELEVANT AROMATIC-CATIONIC PEPTIDES ADM2, VIP, ANPEP CTSL 200/4885KLK7 649/4885KLK5 1105/4885

“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