SCHEMBL8796963

SCHEMBL8796963

O=S(=O)(CF)Nc1nccs1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.49
LMNA P02545 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
KDM4E B2RXH2 1/20 0.49
CYP2C9 P11712 1/20 0.49
EDNRA P25101 1/20 0.49
SLC6A4 P31645 1/20 0.49
ADRA1A P35348 1/20 0.49
PRMT6 Q96LA8 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
PKM P14618 5/20 0.47
ACP1 P24666 2/20 0.46
SCN3A Q9NY46 2/20 0.46
CYP1A2 P05177 1/20 0.44
USP2 O75604 1/20 0.44
MAPT P10636 1/20 0.44
ESR2 Q92731 1/20 0.44
HSD17B10 Q99714 1/20 0.44
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42

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
SCHEMBL11979598 0.83 ALDH1A1 (0.50) ALDH1A1LMNASMN1; SMN2KDM4ECYP2C9
SCHEMBL5710108 0.77 ALDH1A1 (0.50) ALDH1A1LMNASMN1; SMN2KDM4ECYP2C9
SCHEMBL30419982 0.76 PKM (0.49) ALDH1A1LMNASMN1; SMN2KDM4ECYP2C9
SCHEMBL11979597 0.76 ACP1 (0.53) ALDH1A1LMNASMN1; SMN2KDM4ECYP2C9
SCHEMBL30338934 0.76 EPHX2 (0.46) ALDH1A1LMNASMN1; SMN2KDM4ECYP2C9
SCHEMBL10419649 0.75 NAMPT (0.53) ALDH1A1LMNASMN1; SMN2KDM4ECYP2C9
SCHEMBL28780801 0.75 LMNA (0.57) ALDH1A1LMNASMN1; SMN2KDM4ECYP2C9
SCHEMBL14009908 0.75 ACP1 (0.61) ALDH1A1LMNASMN1; SMN2KDM4ECYP2C9
SCHEMBL2912774 0.75 ALDH1A1 (0.53) ALDH1A1LMNASMN1; SMN2KDM4ECYP2C9
SCHEMBL1647188 0.75 ALDH1A1 (0.57) ALDH1A1LMNASMN1; SMN2KDM4ECYP2C9

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-0772606-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1997-05-14 EP disclosed
WO-1996003392-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 WO disclosed