SCHEMBL5333347

SCHEMBL5333347

COc1ccc(OC)c(Nc2nccc3sc(C)cc23)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.54
MEN1 O00255 5/20 0.54
KMT2A Q03164 5/20 0.54
ALDH1A1 P00352 4/20 0.54
KDM4E B2RXH2 3/20 0.54
HPGD P15428 2/20 0.54
RAB9A P51151 2/20 0.49
NPC1 O15118 2/20 0.49
CTDSP1 Q9GZU7 1/20 0.48
GAA P10253 4/20 0.47
MAPK1 P28482 3/20 0.47
HSD17B10 Q99714 2/20 0.47
HTT P42858 1/20 0.47
SRC P12931 1/20 0.47
EGFR P00533 2/20 0.47
ERBB3 P21860 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
USP2 O75604 1/20 0.47
LMNA P02545 1/20 0.47

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
SCHEMBL5311745 0.84 MAPT (0.70) MAPTMEN1KMT2AALDH1A1KDM4E
Hydrochloric Acid SCHEMBL5463629 0.83 MEN1 (0.72) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5314760 0.81 MEN1 (0.57) MAPTMEN1KMT2AALDH1A1KDM4E
Hydrochloric Acid SCHEMBL5369271 0.81 MEN1 (0.56) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5315121 0.77 GAA (0.48) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5371558 0.73 CLK1 (0.47) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL5466877 0.72 MEN1 (0.84) MAPTMEN1KMT2AALDH1A1KDM4E
Hydrochloric Acid SCHEMBL5369266 0.72 MEN1 (0.82) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5334395 0.71 EGFR (0.51) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5467182 0.71 MAPT (0.56) MAPTMEN1KMT2AALDH1A1KDM4E

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