SCHEMBL3653259

SCHEMBL3653259

COc1ccc(Cc2csc(N3CCN(S(=O)(=O)c4cccc(C(F)(F)F)c4)CC3)n2)cc1.O=S(=O)(c1cccc(C(F)(F)F)c1)N1CCN(c2nc(Cc3ccc(Cl)cc3)cs2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
MAPT P10636 3/20 0.46
HSD17B10 Q99714 2/20 0.46
USP2 O75604 1/20 0.46
RECQL P46063 1/20 0.46
POLB P06746 4/20 0.45
HTT P42858 1/20 0.45
ALDH1A1 P00352 4/20 0.44
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MAPK1 P28482 2/20 0.44
KDM4E B2RXH2 2/20 0.43
HSD11B1 P28845 2/20 0.43
GBA1 P04062 2/20 0.42
KCNQ1 P51787 1/20 0.42
GAA P10253 2/20 0.41
ALOX15 P16050 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TSHR P16473 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41

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
SCHEMBL3002340 0.96 L3MBTL1 (0.50) L3MBTL1MAPTHSD17B10USP2RECQL
SCHEMBL3010945 0.93 HTT (0.51) USP2POLBHTTALDH1A1LMNA
SCHEMBL3009774 0.89 MAPT (0.49) L3MBTL1MAPTHSD17B10USP2RECQL
SCHEMBL3011882 0.89 MAPT (0.52) L3MBTL1MAPTHSD17B10USP2RECQL
SCHEMBL3016067 0.88 ALDH1A1 (0.51) MAPTHSD17B10USP2RECQLPOLB
SCHEMBL3014785 0.88 POLB (0.49) L3MBTL1MAPTHSD17B10USP2RECQL
SCHEMBL3011319 0.87 HTT (0.51) USP2POLBHTTALDH1A1LMNA
SCHEMBL3009537 0.87 POLB (0.52) L3MBTL1MAPTPOLBHTTALDH1A1
SCHEMBL3016124 0.87 HTT (0.51) POLBHTTALDH1A1LMNASMN1; SMN2
SCHEMBL3010397 0.86 ALDH1A1 (0.59) L3MBTL1MAPTHSD17B10USP2RECQL

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