SCHEMBL7252297

SCHEMBL7252297

O=C1SC(c2ccc(O)cc2)C(=O)N1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.55
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPT P10636 5/20 0.47
THRB P10828 2/20 0.47
ALDH1A1 P00352 3/20 0.46
GAA P10253 1/20 0.44
EP300 Q09472 1/20 0.44
TP53 P04637 1/20 0.43
ME1 P48163 1/20 0.43
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
MAPK1 P28482 1/20 0.42
F2 P00734 1/20 0.42
PLG P00747 1/20 0.42
ELANE P08246 1/20 0.42
CTSG P08311 1/20 0.42
CMA1 P23946 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
SCHEMBL28259783 0.75 POLB (0.63) POLBMEN1KMT2AMAPTTHRB
SCHEMBL7469304 0.72 POLB (0.55) POLBMEN1KMT2AMAPTTHRB
SCHEMBL5167815 0.71 ALDH1A1 (0.43) POLBMEN1KMT2AMAPTTHRB
SCHEMBL5169747 0.70 LMNA (0.51) POLBMEN1KMT2AMAPTALDH1A1
SCHEMBL10858951 0.70 ACE (0.43) POLBMEN1KMT2AL3MBTL1
SCHEMBL11276340 0.70 CA2 (0.38) POLBMEN1KMT2AMAPTTHRB
SCHEMBL6032173 0.70 MAPT (0.54) POLBMEN1KMT2AMAPTTHRB
Bromide SCHEMBL11277120 0.69 CA2 (0.37) POLBMEN1KMT2AMAPTTHRB
SCHEMBL6037064 0.69 POLB (0.58) POLBMEN1KMT2AMAPTTHRB
SCHEMBL7291421 0.67 CYP2C19 (0.41) POLBMEN1KMT2AALDH1A1MAPK1

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-2003029251-A1 NOVEL PROCESS FOR THE SYNTHESIS OF THIAZOLIDINEDIONE DERIVATIVES BIOCON LIMITED (IN) 2003-04-10 WO disclosed