SCHEMBL12433946

SCHEMBL12433946

Cc1cc(-c2ccc(N(c3ccccc3)c3cc4ccccc4c4ccccc34)cc2)c2ccc3c(-c4ccc(N(c5ccccc5)c5cc6ccccc6c6ccccc56)cc4)cc(C)c4ccc1c2c43

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.37
CYP1A2 P05177 2/20 0.34
CYP2A6 P11509 1/20 0.34
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.34
HPGD P15428 2/20 0.34
KDM4E B2RXH2 2/20 0.34
MPI P34949 1/20 0.34
CYP11B1 P15538 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
USP2 O75604 1/20 0.32
MAPK1 P28482 1/20 0.32
CTNNB1 P35222 1/20 0.32
ATM Q13315 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HSD17B10 Q99714 1/20 0.31
CRHR1 P34998 1/20 0.31

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
SCHEMBL17263975 0.87 KDM4E (0.33) CYP1A2ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL22671106 0.86 GPR84 (0.43) GPR84ALDH1A1MEN1MAPTKMT2A
SCHEMBL13758038 0.85 MEN1 (0.40) GPR84ALDH1A1MEN1MAPTKMT2A
SCHEMBL12433908 0.85 MAPT (0.37) CYP1A2CYP2A6ALDH1A1MEN1MAPT
SCHEMBL804834 0.83 CYP11B1 (0.44) GPR84ALDH1A1MEN1MAPTKMT2A
SCHEMBL23472039 0.82 GPR84 (0.44) GPR84ALDH1A1MEN1MAPTKMT2A
SCHEMBL22671005 0.82 MEN1 (0.40) GPR84ALDH1A1MEN1MAPTKMT2A
SCHEMBL22669945 0.82 GPR84 (0.44) GPR84ALDH1A1MEN1MAPTKMT2A
SCHEMBL24221728 0.82 CYP11B1 (0.42) GPR84ALDH1A1MEN1MAPTKMT2A
SCHEMBL185349 0.82 TRPM4 (0.38) GPR84CYP1A2CYP2A6ALDH1A1MEN1

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
US-7981523-B2 Aromatic amine derivative and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2011-07-19 US disclosed
US-7981523-B2 Aromatic amine derivative and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2011-07-19 US disclosed