SCHEMBL3655535

SCHEMBL3655535

COc1ccc(-c2csc(N3CCN(S(=O)(=O)c4cc(Cl)ccc4OC)CC3)n2)cc1OC.COc1ccc(OC)c(-c2csc(N3CCN(S(=O)(=O)c4cc(Cl)ccc4OC)CC3)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
RECQL P46063 3/20 0.51
NPC1 O15118 1/20 0.51
USP2 O75604 1/20 0.51
HSD17B10 Q99714 1/20 0.51
REV1 Q9UBZ9 1/20 0.49
KMT2A Q03164 6/20 0.47
MEN1 O00255 4/20 0.47
LMNA P02545 2/20 0.47
TSHR P16473 1/20 0.47
POLB P06746 2/20 0.47
ALDH1A1 P00352 6/20 0.47
KDM4E B2RXH2 3/20 0.47
HPGD P15428 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
NTSR1 P30989 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HTT P42858 1/20 0.45

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
SCHEMBL3016303 0.94 REV1 (0.54) MAPTRAB9ASMN1; SMN2RECQLUSP2
SCHEMBL3016726 0.92 MAPT (0.59) MAPTRAB9ASMN1; SMN2RECQLNPC1
SCHEMBL3016180 0.90 REV1 (0.53) MAPTRAB9ARECQLUSP2HSD17B10
SCHEMBL3009587 0.90 POLB (0.56) MAPTRAB9ASMN1; SMN2RECQLNPC1
SCHEMBL3003931 0.90 MAPT (0.60) MAPTRAB9ASMN1; SMN2RECQLNPC1
SCHEMBL3016814 0.88 REV1 (0.53) MAPTRAB9ARECQLUSP2HSD17B10
SCHEMBL3019105 0.88 ALDH1A1 (0.52) MAPTRAB9ARECQLUSP2HSD17B10
SCHEMBL3648442 0.88 MAPT (0.49) MAPTRAB9ASMN1; SMN2RECQLNPC1
SCHEMBL3000043 0.88 MAPT (0.54) MAPTRAB9ASMN1; SMN2RECQLNPC1
SCHEMBL3003590 0.88 MAPT (0.58) MAPTRAB9ASMN1; SMN2RECQLNPC1

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