SCHEMBL6154297

SCHEMBL6154297

Cc1c2c(c(C#N)c3ccccc13)C1c3ccccc3C2c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.38
ALDH1A1 P00352 8/20 0.38
MAPT P10636 6/20 0.38
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
GAA P10253 3/20 0.38
CACNA1B Q00975 1/20 0.38
APBA1 Q02410 1/20 0.38
GRM6 O15303 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 3/20 0.34
ADRA2A P08913 1/20 0.34
ADORA2A P29274 1/20 0.34
HTT P42858 1/20 0.34
MAPK1 P28482 2/20 0.34
ALOX15 P16050 2/20 0.34
PKM P14618 1/20 0.34
EGFR P00533 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
SCHEMBL6155635 0.77 PADI4 (0.36) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL6155153 0.77 KDM4E (0.34) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL12495375 0.76 ALDH1A1 (0.52) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL13949749 0.74 ALDH1A1 (0.52) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL5252145 0.72 ALDH1A1 (0.46) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL6156083 0.72 ALDH1A1 (0.35) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL17639864 0.71 HTR2A (0.40) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL12550563 0.71 MEN1 (0.40) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL25626321 0.69 HTR2A (0.39) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL22953054 0.69 KDM4E (0.46) KDM4EALDH1A1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1027399-B1 TRYPTICENE DERIVATIVES AND THEIR USE IN OPTOELECTRONIC DEVICES, IN PARTICULAR AS ELECTROLUMINESCENT MATERIALS COVION ORGANIC SEMICONDUCTORS (DE) 2005-02-02 EP disclosed
US-6509110-B1 Illumination or display devices for improving property profile AXIVA GMBH (DE) 2003-01-21 US disclosed
EP-1027399-A1 TRYPTICENE DERIVATIVES AND THEIR USE IN OPTOELECTRONIC DEVICES, IN PARTICULAR AS ELECTROLUMINESCENT MATERIALS Axiva GmbH (DE) 2000-08-16 EP disclosed
WO-1999019419-A1 TRYPTICENE DERIVATIVES AND THEIR USE IN OPTOELECTRONIC DEVICES, IN PARTICULAR AS ELECTROLUMINESCENT MATERIALS AXIVA GMBH (DE) 1999-04-22 WO disclosed