SCHEMBL28651663

SCHEMBL28651663

CCOC(=O)c1cscc1C(=O)OC

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.52
ALDH1A1 P00352 6/20 0.44
HSD17B10 Q99714 3/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 5/20 0.43
MEN1 O00255 3/20 0.43
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA7 P43166 2/20 0.43
CA9 Q16790 2/20 0.43
CA14 Q9ULX7 2/20 0.43
KDM4E B2RXH2 5/20 0.43
ALOX15 P16050 1/20 0.43
MAPT P10636 3/20 0.42
LMNA P02545 1/20 0.42
L3MBTL1 Q9Y468 1/20 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
SCHEMBL1498218 0.92 TSHR (0.59) TSHRALDH1A1HSD17B10GAAMAPK1
SCHEMBL68934 0.85 TSHR (0.46) TSHRALDH1A1HSD17B10GAACA12
SCHEMBL18830973 0.83 TSHR (0.50) TSHRALDH1A1HSD17B10GAAMAPK1
SCHEMBL5468755 0.82 TSHR (0.53) TSHRALDH1A1HSD17B10GAAMAPK1
SCHEMBL13913259 0.82 PTPN1 (0.46) TSHRALDH1A1HSD17B10GAAKMT2A
SCHEMBL12233265 0.81 TSHR (0.52) TSHRALDH1A1HSD17B10GAAMAPK1
SCHEMBL3960185 0.80 ALDH1A1 (0.51) ALDH1A1HSD17B10KMT2AMEN1KDM4E
SCHEMBL4184254 0.79 ALDH1A1 (0.56) TSHRALDH1A1HSD17B10GAAMAPK1
SCHEMBL334772 0.79 TSHR (0.50) TSHRALDH1A1HSD17B10GAAMAPK1
SCHEMBL17885225 0.79 TSHR (0.50) TSHRALDH1A1HSD17B10GAAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113735820-A Preparation process of 2, 5-thiophenedicarboxylic acid 苏州求索生物科技有限公司 2021-12-03 CN claimed
CN-118791461-A Method for preparing thiophene ester compound from levulinate ester compound 厦门大学 2024-10-18 CN disclosed
CN-117486855-A Process for preparing 2, 5-thiophenedicarboxylic acid 三门峡奥科科技有限公司 2024-02-02 CN disclosed
CN-113735820-A Preparation process of 2, 5-thiophenedicarboxylic acid 苏州求索生物科技有限公司 2021-12-03 CN disclosed
CN-113735820-A Preparation process of 2, 5-thiophenedicarboxylic acid 苏州求索生物科技有限公司 2021-12-03 CN disclosed