SCHEMBL5550800

SCHEMBL5550800

OCC1CCN(Nc2cccc(Cl)c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
POLB P06746 2/20 0.45
ALOX5 P09917 1/20 0.45
USP30 Q70CQ3 2/20 0.44
EPHX2 P34913 3/20 0.44
EPHX1 P07099 1/20 0.42
PIM1 P11309 1/20 0.41
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.39
GBA1 P04062 1/20 0.39

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
SCHEMBL5546241 0.89 USP30 (0.43) L3MBTL1POLBUSP30EPHX2EPHX1
SCHEMBL5551989 0.83 KMT2A (0.44) L3MBTL1POLBEPHX2EPHX1ALDH1A1
SCHEMBL5550133 0.82 KDM4E (0.45) POLBEPHX2ALDH1A1MEN1KMT2A
SCHEMBL5547460 0.80 ALOX5 (0.46) POLBALOX5ALDH1A1MEN1KMT2A
SCHEMBL5550674 0.78 MAPT (0.43) L3MBTL1POLBUSP30EPHX2EPHX1
SCHEMBL5546230 0.77 ALDH1A1 (0.54) L3MBTL1ALDH1A1MEN1RECQLKMT2A
SCHEMBL5550785 0.76 HTR6 (0.53) ALDH1A1MEN1RECQLKMT2ANPSR1
SCHEMBL5550713 0.76 KMT2A (0.53) L3MBTL1EPHX2EPHX1ALDH1A1MEN1
SCHEMBL28676055 0.73 ALDH1A1 (0.50) POLBALDH1A1MEN1RECQLKMT2A
SCHEMBL5550053 0.72 KMT2A (0.43) L3MBTL1EPHX2EPHX1ALDH1A1MEN1

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