SCHEMBL8149388

SCHEMBL8149388

COC(=O)[C@H](CC(=O)N(C)C)NC(=O)OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KYNU Q16719 1/20 0.58
ALDH1A1 P00352 1/20 0.56
ALOX15 P16050 1/20 0.56
CTSK P43235 7/20 0.53
CTSS P25774 6/20 0.53
CTSL P07711 5/20 0.53
CTSB P07858 5/20 0.53
TRPM8 Q7Z2W7 1/20 0.50
CASP1 P29466 1/20 0.50
CYP3A4 P08684 2/20 0.49
TSHR P16473 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
SCHEMBL9848644 0.93 CTSK (0.54) KYNUALDH1A1ALOX15CTSKCTSS
SCHEMBL15381003 0.90 ALDH1A1 (0.56) KYNUALDH1A1ALOX15CTSKCTSS
SCHEMBL14677202 0.90 CTSK (0.56) KYNUALDH1A1ALOX15CTSKCTSS
SCHEMBL13724740 0.86 CASP1 (0.64) KYNUALDH1A1ALOX15CTSKCASP1
SCHEMBL1067460 0.86 CASP1 (0.64) KYNUALDH1A1ALOX15CTSKCASP1
SCHEMBL19695419 0.86 CASP1 (0.64) KYNUALDH1A1ALOX15CTSKCASP1
SCHEMBL12400686 0.85 KYNU (0.62) KYNUALDH1A1ALOX15CTSKCTSS
SCHEMBL2617394 0.85 KYNU (0.62) KYNUALDH1A1ALOX15CTSKCTSS
SCHEMBL345952 0.85 ALDH1A1 (0.63) KYNUALDH1A1ALOX15CTSKCTSS
SCHEMBL12208731 0.85 ALDH1A1 (0.63) KYNUALDH1A1ALOX15CTSKCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100239551-A1 COMPOUNDS AND COMPOSITIONS AS CHANNEL ACTIVATING PROTEASE INHIBITORS IRM LLC (BM) 2010-09-23 US disclosed
US-20100239551-A1 COMPOUNDS AND COMPOSITIONS AS CHANNEL ACTIVATING PROTEASE INHIBITORS IRM LLC (BM) 2010-09-23 US disclosed
WO-2008097673-A1 COMPOUNDS AND COMPOSITIONS AS CHANNEL ACTIVATING PROTEASE INHIBITORS IRM LLC (BM) 2008-08-14 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-20100239551-A1 COMPOUNDS AND COMPOSITIONS AS CHANNEL ACTIVATING PROTEASE INHIBITORS PRSS8, PRSS1, PRSS2 KYNU 4465/4885ALDH1A1 4130/4885ALOX15 2336/4885

“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.