SCHEMBL3653209

SCHEMBL3653209

COc1cc(-c2csc(N3CCN(S(=O)(=O)c4ccc(F)c(Cl)c4)CC3)n2)cc(OC)c1OC.Cc1cc(C)c(-c2csc(N3CCN(S(=O)(=O)c4ccc(F)c(Cl)c4)CC3)n2)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.51
RECQL P46063 2/20 0.51
USP2 O75604 1/20 0.51
HSD17B10 Q99714 1/20 0.51
SMN1; SMN2 Q16637 6/20 0.49
ALDH1A1 P00352 4/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MAPK1 P28482 4/20 0.47
GAA P10253 1/20 0.47
POLB P06746 2/20 0.44
LMNA P02545 6/20 0.41
HTT P42858 3/20 0.41
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
G6PD P11413 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KDM4E B2RXH2 1/20 0.39
NTSR1 P30989 1/20 0.39
TDP1 Q9NUW8 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
SCHEMBL3005913 0.93 MAPT (0.57) MAPTRECQLUSP2HSD17B10SMN1; SMN2
SCHEMBL3654950 0.90 SMN1; SMN2 (0.52) MAPTRECQLUSP2HSD17B10SMN1; SMN2
SCHEMBL3011343 0.89 ALDH1A1 (0.54) MAPTRECQLUSP2HSD17B10SMN1; SMN2
SCHEMBL3653002 0.86 MAPT (0.49) MAPTRECQLUSP2HSD17B10SMN1; SMN2
SCHEMBL3651369 0.85 MAPK1 (0.55) MAPTRECQLUSP2HSD17B10SMN1; SMN2
SCHEMBL3652747 0.85 MAPT (0.49) MAPTRECQLUSP2HSD17B10SMN1; SMN2
SCHEMBL3020450 0.85 MAPK1 (0.57) MAPTRECQLUSP2HSD17B10SMN1; SMN2
SCHEMBL3019739 0.85 ALDH1A1 (0.61) MAPTRECQLUSP2HSD17B10SMN1; SMN2
SCHEMBL3009624 0.84 MAPT (0.60) MAPTRECQLUSP2HSD17B10SMN1; SMN2
SCHEMBL3651001 0.84 ALDH1A1 (0.58) MAPTRECQLUSP2HSD17B10SMN1; SMN2

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-2188272-A2 PHENYL- AND BENZYLTHIAZOLYLPIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV Remynd (BE) 2010-05-26 EP disclosed
WO-2009019295-A2 PHENYL- AND BENZYLTHIAZOLYLPIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-02-12 WO disclosed