SCHEMBL5378756

SCHEMBL5378756

COc1ccc(O)c(Nc2nccc3sccc23)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
CSNK2A1 P68400 3/20 0.41
CSNK2A2 P19784 1/20 0.41
CSNK2B P67870 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
RIPK2 O43353 1/20 0.37
KDR P35968 1/20 0.37
SRC P12931 1/20 0.37
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL5314760 0.86 MEN1 (0.57) MEN1KMT2ACSNK2A1NPC1RAB9A
Hydrochloric Acid SCHEMBL5369271 0.85 MEN1 (0.56) MEN1KMT2ACSNK2A1NPC1SRC
SCHEMBL5331600 0.78 EPAS1 (0.52) MEN1KMT2ACSNK2A1CSNK2A2CSNK2B
SCHEMBL5343088 0.78 RAB9A (0.66) MEN1KMT2ACSNK2A1CSNK2A2CSNK2B
SCHEMBL5334384 0.75 MAPT (0.42) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL5335403 0.74 NPC1 (0.46) MEN1KMT2ACSNK2A1CSNK2A2CSNK2B
SCHEMBL5458331 0.73 MEN1 (0.47) MEN1KMT2ACSNK2A1NPC1SRC
SCHEMBL5334156 0.73 MEN1 (0.46) MEN1KMT2ACSNK2A1NPC1RAB9A
SCHEMBL5311682 0.71 CSNK2A2 (0.41) MEN1KMT2ACSNK2A1CSNK2A2CSNK2B
Hydrochloric Acid SCHEMBL5332537 0.71 NPC1 (0.43) MEN1KMT2ACSNK2A1CSNK2A2CSNK2B

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 2 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