SCHEMBL4570017

SCHEMBL4570017

COCCCc1sc(S(N)(=O)=O)c(C(=O)Nc2ncc(Br)s2)c1C

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 13/20 0.57
SMN1; SMN2 Q16637 2/20 0.41
MAPK10 P53779 1/20 0.41
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
PKM P14618 1/20 0.40
RAB9A P51151 1/20 0.40
FPR2 P25090 1/20 0.39
SETD1B Q9UPS6 1/20 0.39

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
SCHEMBL959968 0.94 FBP1 (0.56) FBP1SMN1; SMN2MAPK10NPC1LMNA
SCHEMBL4570117 0.89 FBP1 (0.56) FBP1SMN1; SMN2MAPK10NPC1LMNA
SCHEMBL962082 0.85 FBP1 (0.52) FBP1SMN1; SMN2MAPK10NPC1LMNA
SCHEMBL4570506 0.84 FBP1 (0.56) FBP1SMN1; SMN2MAPK10NPC1LMNA
SCHEMBL4566925 0.83 FBP1 (0.51) FBP1SMN1; SMN2MAPK10NPC1LMNA
SCHEMBL958486 0.82 FBP1 (0.53) FBP1SMN1; SMN2MAPK10NPC1LMNA
SCHEMBL4570288 0.75 FBP1 (0.46) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL4569970 0.74 FBP1 (0.57) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL4570269 0.73 FBP1 (0.60) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL956618 0.73 FBP1 (1.00) FBP1

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-2032548-A1 THIAZOLE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2009-03-11 EP disclosed
WO-2007137962-A1 THIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-12-06 WO disclosed