SCHEMBL8048602

SCHEMBL8048602

C(=Cc1ccc(-c2ccc(C=Cc3ccccc3)cc2N(c2ccccc2)c2ccccc2)cc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 2/20 0.42
MAOA P21397 4/20 0.40
MAOB P27338 4/20 0.40
NFE2L2 Q16236 2/20 0.38
CYP19A1 P11511 2/20 0.38
CYP1A1 P04798 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP1B1 Q16678 1/20 0.38
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
CTNNB1 P35222 1/20 0.37
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PELI1 Q96FA3 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
SCHEMBL8048598 1.00 RELA (0.42) RELAMAOAMAOBNFE2L2CYP19A1
SCHEMBL14196542 0.89 RELA (0.42) RELAMAOAMAOBNFE2L2CYP19A1
SCHEMBL8065697 0.83 RELA (0.44) RELAMAOAMAOBNFE2L2CYP19A1
SCHEMBL14196506 0.81 RELA (0.47) RELAMAOAMAOBNFE2L2CYP19A1
SCHEMBL14196533 0.81 NFE2L2 (0.40) RELAMAOAMAOBNFE2L2CYP19A1
SCHEMBL14196546 0.80 RELA (0.37) RELAMAOAMAOBNFE2L2CYP19A1
SCHEMBL14196548 0.80 RELA (0.37) RELAMAOAMAOBNFE2L2CYP19A1
SCHEMBL14196507 0.80 RELA (0.46) RELAMAOAMAOBNFE2L2CYP19A1
SCHEMBL31025937 0.80 ALDH1A1 (0.38) MEN1ALDH1A1MAPTKMT2AAPP
SCHEMBL12128636 0.80 RXRA (0.42) RELAMAOAMAOBNFE2L2CYP19A1

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
EP-0757088-B1 Organoelectroluminescence device material and organoelectroluminescence device for which the material is adapted TOYO INK MFG CO (JP) 2000-06-07 EP disclosed
US-6001284-A Organoelectroluminescence device material and organoelectroluminescence device for which the material is adapted TOYO INK MANUFACTURING CO., LTD. (JP) 1999-12-14 US disclosed
EP-0757088-A2 Organoelectroluminescence device material and organoelectroluminescence device for which the material is adapted TOYO INK MANUFACTURING CO., LTD. (JP) 1997-02-05 EP disclosed