SCHEMBL18655442

SCHEMBL18655442

C[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCNC(=O)OCc1ccccc1)C(N)=O

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.59
▸ SIRT2 Q8IXJ6 1/20 0.59
▸ CPB1 P15086 1/20 0.57
▸ CPB2 Q96IY4 1/20 0.57
▸ FOLH1 Q04609 3/20 0.56
▸ CA1 P00915 1/20 0.53
▸ CA2 P00918 1/20 0.53
▸ MMP2 P08253 1/20 0.51
▸ MMP9 P14780 1/20 0.51
▸ ANPEP P15144 1/20 0.50
▸ PTGER4 P35408 3/20 0.49
▸ SIRT1 Q96EB6 1/20 0.49

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
SCHEMBL17073781 0.88 CTSL (0.63) CTSLSIRT2CPB1CPB2FOLH1
Hydrochloric Acid SCHEMBL30340169 0.88 SIRT2 (0.60) CTSLSIRT2CPB1CPB2FOLH1
SCHEMBL18659611 0.88 CTSL (0.66) CTSLSIRT2CPB1CPB2FOLH1
SCHEMBL17073778 0.84 CTSL (0.64) CTSLSIRT2
SCHEMBL16869913 0.84 ANPEP (0.61) CTSLSIRT2CPB1CPB2FOLH1
SCHEMBL22674651 0.83 FOLH1 (0.60) SIRT2CPB1CPB2FOLH1CA1
SCHEMBL20794742 0.83 ANPEP (0.60) CTSLSIRT2CPB1CPB2FOLH1
SCHEMBL18659633 0.83 CTSL (0.62) CTSLSIRT2CPB1CPB2FOLH1
SCHEMBL30340359 0.83 MAPT (0.60) CTSLSIRT2CPB1CPB2FOLH1
SCHEMBL14194799 0.83 HTT (0.59) SIRT2CPB1CPB2FOLH1MMP2

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 200/4885SIRT2 2787/4885CPB1 563/4885

“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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