SCHEMBL2930282

SCHEMBL2930282

Cc1ccccc1-c1cccc(Nc2ccc(-c3ccc(N(c4ccccc4)c4ccc(-c5ccc(N(c6ccccc6)c6ccc(-c7ccc(Nc8cccc(-c9ccccc9C)c8)cc7)cc6)cc5)cc4)cc3)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.45
NR1H4 Q96RI1 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 3/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
AR P10275 1/20 0.40
KMT2A Q03164 1/20 0.40
HTR7 P34969 2/20 0.39
FFAR1 O14842 2/20 0.39
TSHR P16473 3/20 0.38
MAPK1 P28482 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C19 P33261 2/20 0.38
CLK4 Q9HAZ1 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
HPGD P15428 1/20 0.38
MCL1 Q07820 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
SCHEMBL6571521 0.96 CNR1 (0.43) CNR1NR1H4NPSR1ALDH1A1MAPT
SCHEMBL130523 0.89 CNR1 (0.54) CNR1NR1H4NPSR1ALDH1A1MAPT
SCHEMBL30232756 0.89 CNR1 (0.54) CNR1NR1H4NPSR1ALDH1A1MAPT
SCHEMBL12955887 0.84 ALDH1A1 (0.52) CNR1NPSR1ALDH1A1MAPTMEN1
SCHEMBL12955702 0.83 NPSR1 (0.64) NPSR1ALDH1A1MAPTMEN1AR
SCHEMBL19393444 0.83 MCL1 (0.45) NR1H4ALDH1A1ARHTR7TSHR
SCHEMBL13020014 0.83 ALDH1A1 (0.47) CNR1NPSR1ALDH1A1MAPTMEN1
SCHEMBL21944199 0.82 HTR7 (0.46) NR1H4ALDH1A1ARHTR7TSHR
SCHEMBL22356061 0.82 CNR1 (0.55) CNR1NR1H4NPSR1ALDH1A1MAPT
SCHEMBL13061699 0.82 HPGD (0.53) NPSR1ALDH1A1MAPTMEN1AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1342769-B1 Organic EL Device TDK CORP (JP) 2010-01-27 EP disclosed
EP-1992672-A1 Organic electroluminescent device TDK Corporation (JP) 2008-11-19 EP disclosed
EP-1342769-A1 Organic EL Device TDK Corporation (JP) 2003-09-10 EP disclosed
US-6603140-B2 Organic EL device TDK CORPORATION (JP) 2003-08-05 US disclosed
US-20020038867-A1 Organic EL device TDK CORPORATION (JP) 2002-04-04 US disclosed
US-6285039-B1 HIGH LUMINANCEL CONTINUOUS LIGHT EMISSION AND RELIABILITY; MULTI-COLOR EMISSION MAY BE POSSIBLE TDK CORPORATION (JP) 2001-09-04 US disclosed