SCHEMBL6155635

SCHEMBL6155635

N#Cc1c2c(c(C=O)c3ccccc13)C1c3ccccc3C2c2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PADI4 Q9UM07 1/20 0.36
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.34
MEN1 O00255 2/20 0.34
GAA P10253 2/20 0.34
KMT2A Q03164 2/20 0.34
MAPT P10636 1/20 0.34
CACNA1B Q00975 1/20 0.34
APBA1 Q02410 1/20 0.34
MAOA P21397 1/20 0.31
THRB P10828 1/20 0.30
ERN1 O75460 1/20 0.30

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
SCHEMBL6154938 0.85 PADI4 (0.47) PADI4KDM4EALDH1A1MEN1GAA
SCHEMBL10488349 0.77 KDM4E (0.47) PADI4KDM4EALDH1A1MEN1GAA
SCHEMBL6155381 0.77 PADI4 (0.40) PADI4KDM4EALDH1A1MEN1GAA
SCHEMBL6154297 0.77 KDM4E (0.38) KDM4EALDH1A1MEN1GAAKMT2A
SCHEMBL13891817 0.76 PADI4 (0.50) PADI4KDM4EALDH1A1MEN1GAA
SCHEMBL6155153 0.72 KDM4E (0.34) KDM4EALDH1A1MEN1GAAKMT2A
SCHEMBL6156083 0.67 ALDH1A1 (0.35) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL17639864 0.66 HTR2A (0.40) KDM4EALDH1A1MEN1GAAKMT2A
SCHEMBL25626321 0.65 HTR2A (0.39) KDM4EALDH1A1MEN1GAAKMT2A
SCHEMBL22953054 0.65 KDM4E (0.46) KDM4EALDH1A1MEN1GAAKMT2A

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-1027399-B1 TRYPTICENE DERIVATIVES AND THEIR USE IN OPTOELECTRONIC DEVICES, IN PARTICULAR AS ELECTROLUMINESCENT MATERIALS COVION ORGANIC SEMICONDUCTORS (DE) 2005-02-02 EP 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