SCHEMBL17809173

SCHEMBL17809173

c1ccc(-c2cccc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cccc(-c7nc(-c8ccccc8)cc(-c8ccccc8)n7)c6)c5c43)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.42
KMT2A Q03164 6/20 0.42
ALDH1A1 P00352 4/20 0.42
HPGD P15428 4/20 0.42
KDM4E B2RXH2 3/20 0.42
MAPT P10636 3/20 0.42
LMNA P02545 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
NTSR1 P30989 1/20 0.38
GAA P10253 1/20 0.37
GLA P06280 1/20 0.37
PDE10A Q9Y233 1/20 0.36
ADORA2A P29274 2/20 0.36
ADORA1 P30542 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
GRM5 P41594 1/20 0.34
TET2 Q6N021 1/20 0.34
TET1 Q8NFU7 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
SCHEMBL22596310 0.96 MEN1 (0.43) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL22596307 0.96 KDM4E (0.42) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL22596268 0.96 KDM4E (0.42) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL22595903 0.96 KDM4E (0.42) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL12175655 0.96 KDM4E (0.45) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL17809106 0.95 KDM4E (0.40) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL22595844 0.95 KDM4E (0.40) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL24163305 0.95 MEN1 (0.44) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL22596368 0.95 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL17809126 0.95 KDM4E (0.41) MEN1KMT2AALDH1A1HPGDKDM4E

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-20160163995-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-06-09 US disclosed
US-20160163995-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-06-09 US disclosed