SCHEMBL5330795

SCHEMBL5330795

COc1ccc(Cl)cc1Nc1cncc2sccc12

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.47
KMT2A Q03164 8/20 0.46
MEN1 O00255 6/20 0.46
POLB P06746 5/20 0.46
IDO1 P14902 1/20 0.45
TDO2 P48775 1/20 0.45
MAPK1 P28482 2/20 0.44
TSHR P16473 2/20 0.44
NPC1 O15118 1/20 0.41
HTT P42858 1/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
HPGD P15428 1/20 0.40
LMNA P02545 1/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL5339343 0.86 ICAM1 (0.42) KMT2AMEN1POLBHTTTP53
SCHEMBL5332098 0.86 MEN1 (0.49) KMT2AMEN1MAPK1TSHRNPC1
SCHEMBL5313426 0.82 PTGS1 (0.46) IRAK4KMT2AMEN1POLBMAPK1
SCHEMBL5331010 0.81 CSNK2A1 (0.51) KMT2AMEN1MAPK1HTTMAPT
SCHEMBL5337352 0.80 GAA (0.43) KMT2AMEN1MAPK1TSHRNPC1
SCHEMBL5329633 0.80 KMT2A (0.52) KMT2AMEN1
SCHEMBL5333560 0.79 MEN1 (0.55) KMT2AMEN1MAPK1NPC1HTT
SCHEMBL23565733 0.76 KMT2A (0.61) KMT2AMEN1POLBMAPK1TSHR
SCHEMBL5335650 0.74 EPAS1 (0.43) KMT2AMEN1TSHRNPC1TP53
SCHEMBL5317673 0.73 TSHR (0.42) MAPK1TSHRHTTTP53MAPT

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