SCHEMBL12433908

SCHEMBL12433908

Cc1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccc3c(C)cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4ccc1c2c34

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.37
ALDH1A1 P00352 3/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
KDM4E B2RXH2 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
APP P05067 2/20 0.35
TNKS2 Q9H2K2 3/20 0.34
PSMB5 P28074 2/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
ATM Q13315 2/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
TLR9 Q9NR96 1/20 0.33
ESR2 Q92731 1/20 0.33

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 0.93 KDM4E (0.33) MAPTALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL12433936 0.88 ALDH1A1 (0.43) MAPTALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL17342496 0.87 CYP1A2 (0.32) MAPTALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL2208703 0.86 ALDH1A1 (0.42) MAPTALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL18212574 0.86 KDM4E (0.31) MAPTALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL12433946 0.85 GPR84 (0.37) MAPTALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL17342494 0.83 MAPT (0.33) MAPTALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL14962036 0.83 ALDH1A1 (0.39) MAPTALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL12433944 0.83 HSD17B1 (0.35) MAPTALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL12433921 0.83 MAPT (0.36) MAPTALDH1A1L3MBTL1KDM4ETDP1

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