SCHEMBL4566925

SCHEMBL4566925

COc1sc(S(N)(=O)=O)c(C(=O)Nc2ncc(Br)s2)c1C

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 15/20 0.51
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 1/20 0.45
LMNA P02545 1/20 0.45
PKM P14618 1/20 0.45
RAB9A P51151 1/20 0.45
MAPK10 P53779 1/20 0.40
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
CSNK2A1 P68400 1/20 0.38
CSNK2A3 Q8NEV1 1/20 0.38

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
SCHEMBL4570506 0.89 FBP1 (0.56) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL4570117 0.86 FBP1 (0.56) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL959968 0.85 FBP1 (0.56) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL4570017 0.83 FBP1 (0.57) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL4570288 0.82 FBP1 (0.46) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL958486 0.81 FBP1 (0.53) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL4569970 0.81 FBP1 (0.57) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL4570269 0.80 FBP1 (0.60) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL957339 0.79 FBP1 (0.60) FBP1
SCHEMBL962082 0.78 FBP1 (0.52) FBP1SMN1; SMN2NPC1LMNAPKM

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