SCHEMBL28140469

SCHEMBL28140469

Cc1ccccc1C1NC(=O)CS1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.66
L3MBTL1 Q9Y468 2/20 0.65
GAA P10253 1/20 0.49
GFER P55789 1/20 0.44
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
PBRM1 Q86U86 1/20 0.41
TNKS2 Q9H2K2 1/20 0.41
ALDH1A1 P00352 3/20 0.40
HTR2C P28335 2/20 0.40
TP53 P04637 2/20 0.39
GSK3B P49841 1/20 0.39
BACE1 P56817 1/20 0.39
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL6827823 0.79 SMN1; SMN2 (1.00) SMN1; SMN2L3MBTL1GAAGFERPBRM1
SCHEMBL10676844 0.79 L3MBTL1 (1.00) SMN1; SMN2L3MBTL1GAAGFERALDH1A1
SCHEMBL17926939 0.79 SMN1; SMN2 (0.60) SMN1; SMN2L3MBTL1GAAGFERTP53
SCHEMBL27407052 0.77 SMN1; SMN2 (0.62) SMN1; SMN2L3MBTL1GAAGFERALDH1A1
SCHEMBL10673115 0.76 SMN1; SMN2 (0.60) SMN1; SMN2L3MBTL1GAAGFERALDH1A1
SCHEMBL10668061 0.75 L3MBTL1 (0.72) SMN1; SMN2L3MBTL1GAAGFERALDH1A1
SCHEMBL16796853 0.72 L3MBTL1 (0.68) SMN1; SMN2L3MBTL1GAAGFERALDH1A1
SCHEMBL29559516 0.72 SMN1; SMN2 (0.56) SMN1; SMN2L3MBTL1GAAGFERALDH1A1
SCHEMBL10678134 0.72 L3MBTL1 (0.76) SMN1; SMN2L3MBTL1GAAGFERALDH1A1
SCHEMBL16797013 0.72 L3MBTL1 (0.68) SMN1; SMN2L3MBTL1GAAGFERALDH1A1

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
CN-104540800-B Process for the preparation of (2Z,5Z)-5-(3-chloro-4- ((R)-2,3-dihydroxypropoxy)benzylidene)-2-(propylimino)-3-(o-tolyl)thiazolidin-4-one and intermediate used in said process 埃科特莱茵药品有限公司 2017-05-10 CN claimed
CN-104540800-B Process for the preparation of (2Z,5Z)-5-(3-chloro-4- ((R)-2,3-dihydroxypropoxy)benzylidene)-2-(propylimino)-3-(o-tolyl)thiazolidin-4-one and intermediate used in said process 埃科特莱茵药品有限公司 2017-05-10 CN disclosed