SCHEMBL3875671

SCHEMBL3875671

O=S(=O)(O)c1c(Cl)nc2n1CCS2

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 3/20 0.73
MAPT P10636 6/20 0.37
GAA P10253 2/20 0.37
XDH P47989 2/20 0.36
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
ALDH1A1 P00352 3/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
HPGD P15428 2/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 2/20 0.33
CYP1A2 P05177 1/20 0.33
RECQL P46063 1/20 0.33
RAB9A P51151 1/20 0.33
USP2 O75604 1/20 0.32
ALOX12 P18054 1/20 0.32

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
SCHEMBL9520652 0.83 HTR6 (0.73) HTR6MAPTGAAXDHLMNA
SCHEMBL1590218 0.67 HTR6 (0.50) HTR6MAPTGAASMN1; SMN2MEN1
SCHEMBL8124056 0.65 HPGD (0.62) HTR6MAPTGAAXDHSMN1; SMN2
SCHEMBL8128304 0.62 MAPT (0.53) HTR6MAPTGAALMNASMN1; SMN2
SCHEMBL16561279 0.58 ALDH1A1 (0.50) MAPTGAAXDHLMNASMN1; SMN2
SCHEMBL3519585 0.57 XDH (0.50) HTR6MAPTGAAXDHLMNA
SCHEMBL5940602 0.55 ALDH1A1 (0.49) HTR6MAPTGAAXDHLMNA
SCHEMBL12012991 0.52 LMNA (0.47) HTR6MAPTXDHLMNASMN1; SMN2
SCHEMBL17011660 0.51
SCHEMBL10520868 0.51 ALDH1A1 (0.32) ALDH1A1HPGD

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2116546-A1 Substituted N-phenyl-2,3-dihydroimidazo[2,1-b]thiazole-5-sulfonamide derivatives as 5-HT6 ligands Laboratorios Del. Dr. Esteve, S.A. (ES) 2009-11-11 EP disclosed