SCHEMBL8716232

SCHEMBL8716232

CC(O)N(C)c1nccs1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 5/20 0.42
SCN1A P35498 1/20 0.37
SCN2A Q99250 1/20 0.37
SCN3A Q9NY46 1/20 0.37
ALDH1A1 P00352 2/20 0.35
LMNA P02545 3/20 0.35
KDM4E B2RXH2 1/20 0.35
HTR7 P34969 1/20 0.34
TSHR P16473 2/20 0.33
NR3C1 P04150 1/20 0.33
NOS1 P29475 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ADORA2A P29274 1/20 0.32
HSPA9 P38646 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
FBP1 P09467 1/20 0.31
PDK1 Q15118 1/20 0.31
HSPA5 P11021 1/20 0.31
ALOX15 P16050 1/20 0.31

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
SCHEMBL14099264 0.83 SCN1A (0.42) FFAR2SCN1ASCN2ASCN3AALDH1A1
SCHEMBL9790850 0.74 FDPS (0.45) FFAR2SCN1ASCN2ASCN3AALDH1A1
SCHEMBL1903243 0.73
SCHEMBL20761278 0.72 FFAR2 (0.59) FFAR2ALDH1A1LMNATSHRNR3C1
Hydrochloric Acid SCHEMBL17080155 0.72
SCHEMBL3022750 0.71 POLB (0.44) FFAR2SCN1ASCN2ASCN3AALDH1A1
SCHEMBL2220312 0.70
SCHEMBL18225231 0.70
SCHEMBL2006379 0.69
SCHEMBL19997269 0.69 FFAR2 (0.37) FFAR2SCN1ASCN2ASCN3AALDH1A1

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
US-5756525-A USING A THIAZOLIDINEDIONE COMPOUND BEECHAM GROUP PLC (GB) 1998-05-26 US disclosed