SCHEMBL5483645

SCHEMBL5483645

c1ccc2nnc(-c3cc4ccccc4nn3)cc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
MAPT P10636 3/20 0.55
HPGD P15428 3/20 0.55
GLA P06280 2/20 0.55
ACHE P22303 1/20 0.55
KDM4E B2RXH2 3/20 0.54
NQO2 P16083 2/20 0.46
GPR3 P46089 1/20 0.43
CYP1A2 P05177 1/20 0.41
PDPK1 O15530 1/20 0.41
GAA P10253 2/20 0.40
HTR3A P46098 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
STAT3 P40763 1/20 0.40
KMT2A Q03164 3/20 0.39
NPC1 O15118 2/20 0.39
POLB P06746 2/20 0.39
LMNA P02545 1/20 0.39
PTBP1 P26599 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL31115164 1.00 ALDH1A1 (0.55) ALDH1A1MAPTHPGDGLAACHE
SCHEMBL18806848 0.88 KDM4E (0.48) ALDH1A1MAPTHPGDGLAACHE
SCHEMBL3923106 0.86 SMARCA2 (0.48) ALDH1A1MAPTHPGDGLAACHE
SCHEMBL27898152 0.84 SMARCA2 (0.47) ALDH1A1MAPTHPGDGLAACHE
SCHEMBL6247283 0.82 KDM4E (0.41) ALDH1A1MAPTHPGDGLAACHE
SCHEMBL28673032 0.82 KDM4E (0.41) ALDH1A1MAPTHPGDGLAACHE
SCHEMBL29213516 0.82 KDM4E (0.44) ALDH1A1MAPTHPGDGLAACHE
SCHEMBL18015153 0.80 MAOB (0.49) ALDH1A1MAPTHPGDGLAACHE
SCHEMBL21203011 0.80 KDM4E (0.42) ALDH1A1MAPTHPGDGLAACHE
SCHEMBL14035649 0.80 MEN1 (0.51) ALDH1A1MAPTHPGDKDM4ENQO2

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-7183010-B2 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK CORPORATION (US) 2007-02-27 US disclosed
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 US disclosed