SCHEMBL8594643

SCHEMBL8594643

O=C1/C(=C\c2ccc(-c3cccc(O)c3)o2)SC(=S)N1Cc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.71
KMT2A Q03164 6/20 0.71
MAPT P10636 5/20 0.71
ALDH1A1 P00352 4/20 0.71
POLB P06746 4/20 0.71
MCL1 Q07820 3/20 0.71
RECQL P46063 3/20 0.71
NPSR1 Q6W5P4 2/20 0.71
TDP1 Q9NUW8 2/20 0.71
EIF4E P06730 1/20 0.71
EIF4G1 Q04637 1/20 0.71
THRB P10828 1/20 0.71
ATM Q13315 1/20 0.66
ENPP2 Q13822 1/20 0.66
LMNA P02545 2/20 0.63
ALOX12 P18054 2/20 0.63
MAP3K5 Q99683 3/20 0.62
APEX1 P27695 1/20 0.62
SYK P43405 1/20 0.61
DUSP3 P51452 1/20 0.60

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
SCHEMBL8594645 1.00 MEN1 (0.71) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL3132319 0.90 MAPT (0.73) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL3132334 0.90 MAPT (0.73) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL3132328 0.90 MAPT (0.73) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL3892304 0.89 APEX1 (0.79) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL29701307 0.89 APEX1 (0.79) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL3892300 0.89 APEX1 (0.79) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL3890923 0.86 MAP3K5 (0.70) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL3890920 0.86 MAP3K5 (0.70) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL8289174 0.86 MAP3K5 (0.70) MEN1KMT2AMAPTALDH1A1POLB

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-1998053790-A2 COMPOUNDS THAT INHIBIT THE BINDING OF VASCULAR ENDOTHELIAL GROWTH FACTOR TO ITS RECEPTORS TEXAS BIOTECHNOLOGY CORPORATION (US) 1998-12-03 WO claimed