SCHEMBL18232168

SCHEMBL18232168

c1ccc(-c2nc(-n3c4ccccc4c4c5ccccc5c(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc43)nc3ccccc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 5/20 0.44
HPGD P15428 4/20 0.44
MAPT P10636 3/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 5/20 0.42
LMNA P02545 1/20 0.41
ATM Q13315 3/20 0.38
MAPK1 P28482 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
POLB P06746 1/20 0.38
NUDT1 P36639 3/20 0.36
ADORA2A P29274 2/20 0.36
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
GAA P10253 1/20 0.34
ESR1 P03372 1/20 0.34

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
SCHEMBL17408534 0.94 ALDH1A1 (0.45) ALDH1A1KDM4EHPGDMAPTNPSR1
SCHEMBL15860367 0.94 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDMAPTNPSR1
SCHEMBL18232167 0.94 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDMAPTNPSR1
SCHEMBL17408732 0.94 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDMAPTNPSR1
SCHEMBL17408752 0.94 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDMAPTNPSR1
SCHEMBL16785751 0.93 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDMAPTNPSR1
SCHEMBL19979435 0.93 KDM4E (0.40) ALDH1A1KDM4EHPGDMAPTNPSR1
SCHEMBL19979419 0.93 KDM4E (0.40) ALDH1A1KDM4EHPGDMAPTNPSR1
SCHEMBL17408521 0.93 KDM4E (0.40) ALDH1A1KDM4EHPGDMAPTNPSR1
SCHEMBL17408754 0.93 KDM4E (0.40) ALDH1A1KDM4EHPGDMAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9947878-B2 Organic light-emitting device LG CHEM, LTD. (KR) 2018-04-17 US disclosed
US-9947878-B2 Organic light-emitting device LG CHEM, LTD. (KR) 2018-04-17 US disclosed
US-20170012217-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2017-01-12 US disclosed
US-20170012217-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2017-01-12 US disclosed
US-20160336518-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2016-11-17 US disclosed
US-20160336518-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2016-11-17 US disclosed