SCHEMBL29904992

SCHEMBL29904992

Oc1cc(O)c2c(=S)cc(-c3ccc(O)c(O)c3)oc2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLH Q9Y253 8/20 0.71
MEN1 O00255 6/20 0.71
KMT2A Q03164 6/20 0.71
CYP1A2 P05177 6/20 0.71
CYP1A1 P04798 5/20 0.71
CYP1B1 Q16678 5/20 0.71
KDM4E B2RXH2 4/20 0.71
TP53 P04637 4/20 0.71
CYP3A4 P08684 4/20 0.71
CYP2C9 P11712 4/20 0.71
ALOX15 P16050 4/20 0.71
TSHR P16473 4/20 0.71
HIF1A Q16665 4/20 0.71
HSD17B10 Q99714 4/20 0.71
ALDH1A1 P00352 4/20 0.71
ABCB1 P08183 4/20 0.71
MAPT P10636 4/20 0.71
XDH P47989 4/20 0.71
IPMK Q8NFU5 4/20 0.71
HDAC6 Q9UBN7 4/20 0.71

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
SCHEMBL7942485 0.89 KMT2A (0.68) POLHMEN1KMT2ACYP1A2CYP1A1
Luteolin SCHEMBL20426 0.83 POLH (1.00) POLHMEN1KMT2ACYP1A2CYP1A1
Luteolin SCHEMBL28256564 0.83 POLH (1.00) POLHMEN1KMT2ACYP1A2CYP1A1
Luteolin SCHEMBL29376494 0.83 POLH (1.00) POLHMEN1KMT2ACYP1A2CYP1A1
Luteolin SCHEMBL30045580 0.83 POLH (1.00) POLHMEN1KMT2ACYP1A2CYP1A1
Luteolin SCHEMBL29352380 0.83 POLH (1.00) POLHMEN1KMT2ACYP1A2CYP1A1
Luteolin SCHEMBL1659262 0.82 POLH (0.97) POLHMEN1KMT2ACYP1A2CYP1A1
Luteolin SCHEMBL31539190 0.82 POLH (0.97) POLHMEN1KMT2ACYP1A2CYP1A1
Luteolin SCHEMBL31258014 0.82 POLH (0.97) POLHMEN1KMT2ACYP1A2CYP1A1
Luteolin SCHEMBL31168048 0.82 POLH (0.97) POLHMEN1KMT2ACYP1A2CYP1A1

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
CN-115261422-A Preparation method and application of new species thiolutin 塔里木大学 2022-11-01 CN disclosed