SCHEMBL6607376

SCHEMBL6607376

Cc1noc(C)c1S(=O)(=O)N(C(=O)C[C@@H](C)CC(N)=O)C1CCCNCC1=O

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 3/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 3/20 0.33
POLB P06746 2/20 0.33
PKM P14618 1/20 0.30
DPP4 P27487 1/20 0.30
DPP7 Q9UHL4 1/20 0.30

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
SCHEMBL4767021 0.81
SCHEMBL6607371 0.81 TSHR (0.33) TSHRMEN1KMT2ANPSR1ALDH1A1
SCHEMBL4768444 0.81
SCHEMBL6589463 0.80
SCHEMBL4763307 0.79 PSEN1 (0.32) MEN1KMT2AALDH1A1
SCHEMBL6594106 0.78
SCHEMBL4763252 0.78
SCHEMBL6240356 0.78 SMN1; SMN2 (0.32)
SCHEMBL4762987 0.78 RPLP1 (0.37)
SCHEMBL4767027 0.78 PSEN1 (0.41)

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
EP-1307204-A4 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2004-06-02 EP disclosed
EP-1307204-A1 PROTEASE INHIBITORS SmithKline Beecham Corporation (US) 2003-05-07 EP disclosed
WO-2001095911-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-12-20 WO disclosed