SCHEMBL5843455

SCHEMBL5843455

C=Cc1ccc(Nc2cccc(-c3ccccc3C)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.47
NR1H4 Q96RI1 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HTR7 P34969 3/20 0.39
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
AR P10275 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
FFAR1 O14842 2/20 0.38
FFAR4 Q5NUL3 1/20 0.37
CYP1A2 P05177 3/20 0.37
CYP3A4 P08684 3/20 0.37
CYP2D6 P10635 3/20 0.37
CYP2C19 P33261 3/20 0.37
TSHR P16473 2/20 0.37
MAPK1 P28482 2/20 0.37
CLK4 Q9HAZ1 1/20 0.37
PLCG1 P19174 1/20 0.36
HTR1A P08908 1/20 0.36

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
SCHEMBL7716050 0.88 CNR1 (0.49) CNR1NR1H4NPSR1HTR7ALDH1A1
SCHEMBL7717154 0.88 CNR1 (0.49) CNR1NR1H4NPSR1HTR7ALDH1A1
SCHEMBL7717705 0.86 CNR1 (0.50) CNR1NR1H4NPSR1HTR7ALDH1A1
SCHEMBL130523 0.85 CNR1 (0.54) CNR1NR1H4NPSR1HTR7ALDH1A1
SCHEMBL30232756 0.85 CNR1 (0.54) CNR1NR1H4NPSR1HTR7ALDH1A1
SCHEMBL22356061 0.84 CNR1 (0.55) CNR1NR1H4NPSR1HTR7ALDH1A1
SCHEMBL5845998 0.83 CNR1 (0.43) CNR1NR1H4NPSR1HTR7ALDH1A1
SCHEMBL5845967 0.81 CNR1 (0.50) CNR1NR1H4NPSR1HTR7ALDH1A1
SCHEMBL5844799 0.78 CNR1 (0.48) CNR1NR1H4NPSR1HTR7ALDH1A1
SCHEMBL12549993 0.78 ALDH1A1 (0.54) CNR1NR1H4NPSR1ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7101630-B2 Diarylamino group-containing copolymer, organic electroluminescent device, and method of producing hole transport layer for organic electroluminescent device KAWAMURA INSTITUTE OF CHEMICAL RESEARCH (JP) 2006-09-05 US disclosed
US-20050008893-A1 Diarylamino group-containing copolymer, organic electroluminescent device, and method of producing hole transport layer for organic electroluminescent device KAWAMURA INSTITUTE OF CHEMICAL RESEARCH (JP) 2005-01-13 US disclosed
US-20010017155-A1 Of monovinylated triarylamine monomers; use in light emitting diodes or as components of photorefractive materials CALIFORNIA INSTITUTE OF TECHNOLOGY 2001-08-30 US disclosed