SCHEMBL5314760

SCHEMBL5314760

COc1ccc(OC)c(Nc2nccc3sccc23)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.57
KMT2A Q03164 7/20 0.57
CSNK2A1 P68400 2/20 0.49
MAPT P10636 5/20 0.49
ALDH1A1 P00352 2/20 0.49
KDM4E B2RXH2 1/20 0.49
HPGD P15428 1/20 0.49
GAA P10253 4/20 0.48
LMNA P02545 2/20 0.48
USP2 O75604 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
NPC1 O15118 2/20 0.47
PKM P14618 1/20 0.47
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.46
SRC P12931 1/20 0.46
EGFR P00533 3/20 0.45
ERBB3 P21860 3/20 0.45
RAB9A P51151 1/20 0.44

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
Hydrochloric Acid SCHEMBL5369271 0.99 MEN1 (0.56) MEN1KMT2ACSNK2A1MAPTALDH1A1
SCHEMBL5378756 0.86 MEN1 (0.47) MEN1KMT2ACSNK2A1MAPTALDH1A1
SCHEMBL5334156 0.86 MEN1 (0.46) MEN1KMT2ACSNK2A1MAPTALDH1A1
SCHEMBL5334384 0.83 MAPT (0.42) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL5330316 0.81 CSNK2A1 (0.53) MEN1KMT2ACSNK2A1MAPTHPGD
SCHEMBL5333347 0.81 MAPT (0.54) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL5466877 0.81 MEN1 (0.84) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL5392406 0.81 CSNK2A1 (0.55) MEN1KMT2ACSNK2A1MAPTALDH1A1
Hydrochloric Acid SCHEMBL5369266 0.80 MEN1 (0.82) MEN1KMT2ACSNK2A1MAPTALDH1A1
SCHEMBL5331600 0.79 EPAS1 (0.52) MEN1KMT2ACSNK2A1NPC1SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007056215-A9 N-ARYL-THIENOPYRIMIDIN-4-AMINES AND THE USE THEREOF CYTOVIA INC (US) 2007-09-13 WO claimed
WO-2007056215-A2 N-ARYL-THIENOPYRIMIDIN-4-AMINES AND THE USE THEREOF CYTOVIA, INC. (US) 2007-05-18 WO claimed
WO-2007056215-A9 N-ARYL-THIENOPYRIMIDIN-4-AMINES AND THE USE THEREOF CYTOVIA INC (US) 2007-09-13 WO disclosed