SCHEMBL5551976

SCHEMBL5551976

OC1CCCN(Nc2ccc(F)c(Cl)c2)C1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
ALDH1A1 P00352 2/20 0.43
TRPA1 O75762 1/20 0.43
THRB P10828 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HPGD P15428 1/20 0.42
LMNA P02545 2/20 0.41
CCR2 P41597 1/20 0.41
KCNH2 Q12809 1/20 0.41
MALT1 Q9UDY8 2/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
IDO1 P14902 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
SCHEMBL5550036 0.92 KMT2A (0.45) MAPTKMT2AMEN1ALDH1A1TRPA1
SCHEMBL5550840 0.83 KMT2A (0.47) MAPTKMT2AMEN1ALDH1A1TRPA1
SCHEMBL5550802 0.81 MAPT (0.56) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL5550053 0.81 KMT2A (0.43) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL5550024 0.79 MAPT (0.55) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL5550835 0.78 KDM4E (0.44) MAPTKMT2AMEN1ALDH1A1TRPA1
SCHEMBL5547460 0.74 ALOX5 (0.46) MAPTKMT2AMEN1ALDH1A1THRB
SCHEMBL5546266 0.72 EGFR (0.46) MAPTKMT2AMEN1ALDH1A1THRB
SCHEMBL5550674 0.71 MAPT (0.43) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL5550676 0.71 MAPT (0.46) MAPTKMT2AMEN1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002000649-A9 SUBSTITUTED QUINAZOLINE DERIVATIVES AND THEIR USE AS INHIBITORS ASTRAZENECA AB (SE) 2007-09-20 WO disclosed
CN-1496364-A Substituted quinazoline derivatives and their use as inhibitors 2004-05-12 CN disclosed
EP-1299381-A1 SUBSTITUTED QUINAZOLINE DERIVATIVES AND THEIR USE AS INHIBITORS AstraZeneca AB (SE) 2003-04-09 EP disclosed
WO-2002000649-A1 SUBSTITUTED QUINAZOLINE DERIVATIVES AND THEIR USE AS INHIBITORS ASTRAZENECA AB (SE) 2002-01-03 WO disclosed