SCHEMBL5155505

SCHEMBL5155505

CC[CH]S(=O)(=O)CC1CCNC(=O)C1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.31

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
SCHEMBL13575606 0.82
SCHEMBL5451213 0.82
SCHEMBL5554585 0.80 NOS1 (0.31)
SCHEMBL5554582 0.76
SCHEMBL5502631 0.72 CYP1A2 (0.37) KMT2AALDH1A1
SCHEMBL2526110 0.72 HTT (0.41) ALDH1A1
SCHEMBL8299815 0.71
SCHEMBL26718370 0.69 CYP1A2 (0.46) MEN1KMT2AALDH1A1
SCHEMBL26064924 0.69
SCHEMBL16109535 0.69

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
EP-1866277-A2 SULFONYL CONTAINING COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS CELERA GENOMICS (US) 2007-12-19 EP disclosed
WO-2006102535-A2 SULFONYL CONTAINING COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS CELERA GENOMICS (US) 2006-09-28 WO disclosed