SCHEMBL6006737

SCHEMBL6006737

O=S(=O)(c1ccc(S)cc1)c1ccc(S)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
HTR6 P50406 4/20 0.52
CYP3A4 P08684 2/20 0.52
GAA P10253 2/20 0.52
MAPK1 P28482 1/20 0.52
LMNA P02545 1/20 0.52
MPO P05164 1/20 0.52
CYP2C9 P11712 1/20 0.52
TSHR P16473 1/20 0.52
PKM P14618 4/20 0.46
MAPT P10636 3/20 0.43
POLB P06746 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
IDO1 P14902 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 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
SCHEMBL636314 1.00 ALDH1A1 (0.52) ALDH1A1HTR6CYP3A4GAAMAPK1
SCHEMBL947085 0.89 HTR6 (0.70) ALDH1A1HTR6CYP3A4GAAMAPK1
SCHEMBL9187794 0.87 HSD11B1 (0.47) ALDH1A1HTR6CYP3A4GAAMAPK1
SCHEMBL20108534 0.87 CA2 (0.50) ALDH1A1HTR6CYP3A4GAAMAPK1
SCHEMBL9326670 0.87 ALDH1A1 (0.76) ALDH1A1HTR6CYP3A4GAAMAPK1
SCHEMBL331401 0.87 GAA (0.55) ALDH1A1HTR6CYP3A4GAAMAPK1
SCHEMBL25819444 0.87 GAA (0.76) ALDH1A1CYP3A4GAACYP2C9PKM
SCHEMBL27090263 0.85 HTT (0.55) ALDH1A1CYP3A4GAAMAPK1LMNA
SCHEMBL16435171 0.85 APEX1 (0.45) ALDH1A1HTR6CYP3A4GAAMAPK1
SCHEMBL27844440 0.83 HTR6 (0.54) ALDH1A1HTR6GAAPKMMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006066569-A2 IONOMERS AND IONOMER BLENDS BASED ON PARTIALLY FLUORINATED POLY(HETERO)ARYLS HÄRING, Thomas (DE) 2006-06-29 WO claimed
WO-2006066569-A2 IONOMERS AND IONOMER BLENDS BASED ON PARTIALLY FLUORINATED POLY(HETERO)ARYLS HÄRING, Thomas (DE) 2006-06-29 WO disclosed
EP-0245815-B1 SOLUBLE AND/OR FUSIBLE POLYIMIDES AND POLYAMIDIMIDES Chemie Linz Gesellschaft m.b.H. (AT) 1991-01-02 EP disclosed
EP-0245815-A2 Soluble and/or fusible polyimides and polyamidimides Chemie Linz Gesellschaft m.b.H. (AT) 1987-11-19 EP disclosed