SCHEMBL5550840

SCHEMBL5550840

OC1CCN(Nc2ccc(F)c(Cl)c2)CC1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
MEN1 O00255 3/20 0.47
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
LMNA P02545 2/20 0.45
MALT1 Q9UDY8 2/20 0.44
TSHR P16473 1/20 0.43
TRPA1 O75762 1/20 0.43
HPGD P15428 1/20 0.43
NR1I2 O75469 1/20 0.43
AHR P35869 1/20 0.43
IDO1 P14902 1/20 0.43
GAA P10253 1/20 0.42
SLC2A1 P11166 1/20 0.42

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 0.91 KMT2A (0.45) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL5547460 0.84 ALOX5 (0.46) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL5551976 0.83 MAPT (0.46) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL5550802 0.82 MAPT (0.56) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL5546266 0.82 EGFR (0.46) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL5550024 0.81 MAPT (0.55) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL27262053 0.78 LMNA (0.64) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL5550676 0.78 MAPT (0.46) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL5551989 0.78 KMT2A (0.44) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL5547459 0.75 KDM4E (0.44) KMT2AMEN1ALDH1A1MAPTTRPA1

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