SCHEMBL9570425

SCHEMBL9570425

CS(=O)(=O)OC(C(=O)Oc1ccccc1)C(Cc1ccccc1)c1cccs1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
POLB P06746 3/20 0.37
TDP1 Q9NUW8 3/20 0.37
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
MAPT P10636 3/20 0.36
TP53 P04637 3/20 0.36
THRB P10828 1/20 0.36
ALDH1A1 P00352 4/20 0.35
TSHR P16473 3/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
PLA2G1B P04054 1/20 0.34
ATG4B Q9Y4P1 1/20 0.34
CYP3A4 P08684 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
ALOX15 P16050 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL9570422 0.81 POLB (0.42) LMNAPOLBTDP1PPARGPPARA
SCHEMBL8800892 0.81 PPARG (0.39) LMNAPPARGPPARAMAPTALDH1A1
SCHEMBL8800805 0.80 PPARG (0.41) LMNAPPARGPPARAMAPTALDH1A1
SCHEMBL8801705 0.79 PPARG (0.40) PPARGPPARAMAPTALDH1A1TSHR
SCHEMBL8802092 0.76 PPARG (0.38) LMNAPOLBPPARGPPARAMAPT
SCHEMBL8800961 0.75 TSHR (0.41) POLBPPARGPPARAALDH1A1TSHR
SCHEMBL9570349 0.71 MEN1 (0.41) LMNAALDH1A1TSHRKMT2AMEN1
SCHEMBL11601023 0.69 TSHR (0.43) POLBTDP1MAPTALDH1A1TSHR
SCHEMBL27603064 0.68 CES2 (0.51) POLBTDP1MAPTALDH1A1TSHR
SCHEMBL16377671 0.68 PKM (0.42) POLBTDP1MAPTTP53ALDH1A1

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
EP-0522956-A2 Preparation of 2-(2-thienyl) ethylamine and synthesis of thieno [3,2-C] pyridine derivatives therefrom SANOFI (FR) 1993-01-13 EP disclosed