SCHEMBL6091973

SCHEMBL6091973

CSCC[C@H](NC(=O)O)C(C)=O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 1/20 0.44
RNPEP Q9H4A4 1/20 0.44
MEN1 O00255 1/20 0.40
CRHBP P24387 1/20 0.40
KMT2A Q03164 1/20 0.40
CRHR2 Q13324 1/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
POLB P06746 1/20 0.40
USP2 O75604 1/20 0.40
TSHR P16473 1/20 0.40
ANPEP P15144 1/20 0.39
CA2 P00918 1/20 0.39
MAPK1 P28482 1/20 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
SCHEMBL4326342 0.86 LMNA (0.57) ALDH1A1NPSR1LMNARNPEPPOLB
SCHEMBL13603010 0.86 ALDH1A1 (0.43) ALDH1A1NPSR1LMNARNPEPMEN1
SCHEMBL1298472 0.86 LMNA (0.57) ALDH1A1NPSR1LMNARNPEPPOLB
SCHEMBL12018961 0.86 ALDH1A1 (0.43) ALDH1A1NPSR1LMNARNPEPMEN1
SCHEMBL12562326 0.86 ALDH1A1 (0.43) ALDH1A1NPSR1LMNARNPEPMEN1
SCHEMBL28257478 0.84 LMNA (0.55) ALDH1A1NPSR1LMNARNPEPPOLB
SCHEMBL9972470 0.81 CTSS (0.44) ALDH1A1LMNAKMT2ACTSSCTSK
SCHEMBL5990092 0.81 CTSS (0.44) ALDH1A1LMNAKMT2ACTSSCTSK
SCHEMBL3265338 0.81 CTSS (0.44) ALDH1A1LMNAKMT2ACTSSCTSK
SCHEMBL23753625 0.81 CTSS (0.44) ALDH1A1NPSR1LMNARNPEPMEN1

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-20060287402-A1 Cathepsin inhibitors MERCK FROSST CANADA & CO. (CA) 2006-12-21 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-20060287402-A1 Cathepsin inhibitors CTSB, CTSK, CTSS ALDH1A1 2983/4885NPSR1 257/4885LMNA 1726/4885

“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.