SCHEMBL7046716

SCHEMBL7046716

Cc1ccccc1CS(=O)(=O)C[C@H](NC(=O)N1CCOCC1)C(=O)NC(C)(C)C(=O)c1nc2ccccc2o1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 9/20 0.42
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
USP2 O75604 1/20 0.34
MAPK1 P28482 1/20 0.34
P2RY14 Q15391 1/20 0.34
CTSB P07858 2/20 0.34
CTSK P43235 2/20 0.34
CTSH P09668 1/20 0.34
CTSC P53634 1/20 0.34
CTSL P07711 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
SCHEMBL7046715 1.00 CTSS (0.42) CTSSKDM4EALDH1A1HPGDCASP1
SCHEMBL6462035 0.92 CTSS (0.40) CTSSKDM4EALDH1A1MEN1HTT
SCHEMBL7042153 0.92 CTSS (0.40) CTSSKDM4EALDH1A1MEN1HTT
SCHEMBL7044326 0.90 CTSS (0.50) CTSSKDM4ECTSBCTSKCTSH
SCHEMBL6462497 0.90 CTSS (0.50) CTSSKDM4ECTSBCTSKCTSH
SCHEMBL6464315 0.90 CTSS (0.39) CTSSKDM4EALDH1A1HPGDGAA
SCHEMBL6464318 0.90 CTSS (0.39) CTSSKDM4EALDH1A1HPGDGAA
SCHEMBL6462684 0.83 CTSS (0.44) CTSSCTSBCTSKCTSHCTSC
SCHEMBL6466973 0.83 CTSS (0.45) CTSS
SCHEMBL6466966 0.79 CTSS (0.37) CTSSKDM4EALDH1A1HPGDCASP1

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-20030232864-A1 Novel Compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2003-12-18 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-20030232864-A1 Novel Compounds and compositions as protease inhibitors SERPINB1, CTRL, CTSZ CTSS 9/4885KDM4E 2918/4885ALDH1A1 3027/4885

“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.