SCHEMBL21282009

SCHEMBL21282009

N#Cc1ccc2c(c1)c1cc(-c3nc4ccccc4nc3Cl)ccc1n2-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
PKM P14618 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.40
CFTR P13569 1/20 0.40
ALDH1A1 P00352 3/20 0.40
LMNA P02545 2/20 0.40
THRB P10828 1/20 0.40
ADORA2A P29274 1/20 0.39
TDP2 O95551 2/20 0.38
RPS6KB1 P23443 2/20 0.37
GAA P10253 2/20 0.36
GLA P06280 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ATM Q13315 1/20 0.36
PTGER4 P35408 1/20 0.35
RXFP1 Q9HBX9 2/20 0.35
PDE4B Q07343 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
HTT P42858 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
SCHEMBL21174597 0.86 KDM4E (0.50) KDM4EPKML3MBTL1ALDH1A1LMNA
SCHEMBL30421352 0.86 KDM4E (0.50) KDM4EPKML3MBTL1ALDH1A1LMNA
SCHEMBL15250627 0.81 G6PD (0.44) KDM4EL3MBTL1ALDH1A1LMNATDP2
SCHEMBL15250617 0.81 G6PD (0.44) KDM4EL3MBTL1ALDH1A1LMNATDP2
SCHEMBL18012562 0.81 ADORA2A (0.41) KDM4ECFTRALDH1A1LMNATHRB
SCHEMBL17300202 0.80 ADORA2A (0.42) KDM4ECFTRALDH1A1LMNATHRB
SCHEMBL17302687 0.79 ADORA2A (0.37) KDM4ECFTRALDH1A1LMNATHRB
SCHEMBL15761309 0.79 G6PD (0.43) KDM4EL3MBTL1ALDH1A1LMNATDP2
SCHEMBL21679704 0.78 KDM4E (0.50) KDM4EPKML3MBTL1ALDH1A1LMNA
SCHEMBL16809828 0.78 CYP1A2 (0.43) KDM4EALDH1A1LMNATDP2MEN1

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
WO-2019172623-A1 COMPOUND FOR ORGANIC ELECTRIC DEVICE, ORGANIC ELECTRIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2019-09-12 WO disclosed
WO-2019160335-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2019-08-22 WO disclosed