SCHEMBL6465981

SCHEMBL6465981

O=[C]c1nc2c(S)cccc2s1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB8 P28062 1/20 0.44
PSMD14 O00487 2/20 0.36
COPS5 Q92905 2/20 0.36
ALDH1A1 P00352 7/20 0.35
GAA P10253 4/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
LMNA P02545 3/20 0.35
KDM4E B2RXH2 3/20 0.35
HPGD P15428 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
PRNP P04156 1/20 0.35
MAPT P10636 5/20 0.33
PKM P14618 3/20 0.33
MAPK1 P28482 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
DYRK1A Q13627 2/20 0.33
PDPK1 O15530 1/20 0.33

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
SCHEMBL5030198 0.82 PSMB8 (0.65) PSMB8PSMD14COPS5ALDH1A1GAA
SCHEMBL3067465 0.75 PSMD14 (0.42) PSMB8PSMD14COPS5ALDH1A1GAA
SCHEMBL2256808 0.73 PSMD14 (0.41) PSMB8PSMD14COPS5ALDH1A1GAA
SCHEMBL3790319 0.73 ALDH1A1 (0.58) PSMB8PSMD14COPS5ALDH1A1GAA
SCHEMBL2252871 0.73 PSMD14 (0.41) PSMB8PSMD14COPS5ALDH1A1GAA
SCHEMBL9799782 0.73 PSMD14 (0.41) PSMB8PSMD14COPS5ALDH1A1GAA
SCHEMBL4364308 0.72 ALDH1A1 (0.61) PSMD14COPS5ALDH1A1GAAMEN1
SCHEMBL8956341 0.72 PSMD14 (0.39) PSMB8PSMD14COPS5ALDH1A1GAA
SCHEMBL316414 0.72 ALDH1A1 (0.43) PSMD14COPS5ALDH1A1GAALMNA
SCHEMBL3622772 0.72 PDPK1 (0.43) PSMB8PSMD14COPS5ALDH1A1GAA

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-1606329-A1 A PROCESS FOR THE PRODUCTION OF ACID GROUP CONTAINING POLYMER RESIN SigmaKalon B.V. (NL) 2005-12-21 EP disclosed
WO-2004085502-A1 A PROCESS FOR THE PRODUCTION OF ACID GROUP CONTAINING POLYMER RESIN SIGMAKALON B.V. (NL) 2004-10-07 WO disclosed