SCHEMBL9430873

SCHEMBL9430873

CC(=O)Nc1csc(C(=O)CBr)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 5/20 0.39
LMNA P02545 1/20 0.39
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
TP53 P04637 1/20 0.37
HIF1A Q16665 1/20 0.37
POLB P06746 2/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NAPRT Q6XQN6 1/20 0.36
HSD17B10 Q99714 1/20 0.36
RAB9A P51151 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NR4A1 P22736 1/20 0.36
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL9430177 0.80 MAPT (0.50) LMNAALDH1A1GAATDP1TP53
SCHEMBL28490756 0.79 DAO (0.52) LMNAALDH1A1GAATDP1POLB
SCHEMBL12009451 0.76 LMNA (0.41) LMNAALDH1A1GAATDP1HTT
SCHEMBL2995418 0.74 PRKCZ (0.49) LMNAALDH1A1GAATDP1TP53
SCHEMBL15547606 0.73 DAO (0.59) GSK3BLMNAALDH1A1HTTMAPT
SCHEMBL15282434 0.72 GSK3B (0.68) GSK3BLMNAALDH1A1SMN1; SMN2HSD17B10
SCHEMBL939177 0.70 GSK3B (0.46) GSK3BLMNAALDH1A1GAATDP1
SCHEMBL22953102 0.69 GSK3B (0.48) GSK3BLMNAALDH1A1MEN1KMT2A
SCHEMBL2381692 0.69 LMNA (0.46) LMNAALDH1A1GAATDP1TP53
SCHEMBL7813005 0.68 GSK3B (0.52) GSK3B

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
WO-1994029304-A1 THIENYLTHIAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-12-22 WO disclosed