SCHEMBL18913046

SCHEMBL18913046

CCC(C)[C@H](NC(=O)CN)C(=O)NCC(=O)OC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSS P25774 2/20 0.43
CTSK P43235 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.40
BIRC2 Q13490 1/20 0.38
RECQL P46063 1/20 0.38
HTT P42858 1/20 0.37
MME P08473 1/20 0.36
ACE P12821 1/20 0.36
CPA1 P15085 1/20 0.36
ACE2 Q9BYF1 1/20 0.36
CA2 P00918 2/20 0.36
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
TET2 Q6N021 1/20 0.35
FURIN P09958 1/20 0.35
ALDH1A1 P00352 1/20 0.34
ANPEP P15144 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL18913047 1.00 CTSS (0.43) CTSSCTSKL3MBTL1BIRC2RECQL
SCHEMBL22892480 0.85 MME (0.53) CTSSCTSKL3MBTL1HTTMME
SCHEMBL22892432 0.85 MME (0.53) CTSSCTSKL3MBTL1HTTMME
SCHEMBL28706003 0.85 MME (0.53) CTSSCTSKL3MBTL1HTTMME
SCHEMBL22860838 0.81 CTSS (0.42) CTSSCTSKL3MBTL1BIRC2RECQL
SCHEMBL28051158 0.81 CTSS (0.42) CTSSCTSKL3MBTL1BIRC2HTT
SCHEMBL28051156 0.81 CTSS (0.42) CTSSCTSKL3MBTL1BIRC2HTT
SCHEMBL16550867 0.78 CTSS (0.69) CTSSCTSKHTTCA2ALDH1A1
SCHEMBL22636434 0.78 POLB (0.46) HTTALDH1A1KDM4E
SCHEMBL22648533 0.78 POLB (0.46) HTTALDH1A1KDM4E

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-10723766-B2 Derivatives of gamma-amanitin HEIDELBERG PHARMA RESEARCH GMBH (DE) 2020-07-28 US disclosed
WO-2017089607-A1 DERIVATIVES OF GAMMA-AMANITIN HEIDELBERG PHARMA GMBH (DE) 2017-06-01 WO 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-10723766-B2 Derivatives of gamma-amanitin MGAT2, MGAT3, MGAT1 CTSS 3623/4885CTSK 2756/4885L3MBTL1 2309/4885

“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.