SCHEMBL21180585

SCHEMBL21180585

c1ccc2c(c1)cc(-c1ccc3oc4ccccc4c3c1)c1cc3oc4ccccc4c3cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.44
KDM4E B2RXH2 5/20 0.44
HPGD P15428 4/20 0.44
ALDH1A1 P00352 4/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
NPC1 O15118 3/20 0.44
AHR P35869 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALOX5 P09917 1/20 0.41
MAOA P21397 1/20 0.40
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
TSHR P16473 2/20 0.38
HSD17B10 Q99714 2/20 0.38
GLA P06280 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL21180650 1.00 MAPT (0.44) MAPTKDM4EHPGDALDH1A1MEN1
SCHEMBL25052391 0.93 MAPT (0.42) MAPTKDM4EHPGDALDH1A1MEN1
SCHEMBL14725736 0.91 MAPT (0.44) MAPTKDM4EHPGDALDH1A1MEN1
SCHEMBL16472848 0.91 MAPT (0.44) MAPTKDM4EHPGDALDH1A1MEN1
SCHEMBL15461865 0.91 MAPT (0.44) MAPTKDM4EHPGDALDH1A1MEN1
SCHEMBL22141151 0.91 KDM4E (0.49) MAPTKDM4EHPGDALDH1A1MEN1
SCHEMBL1635675 0.91 CYP11B1 (0.44) MAPTKDM4EHPGDALDH1A1MEN1
SCHEMBL25050984 0.89 CYP11B1 (0.41) MAPTKDM4EHPGDALDH1A1MEN1
SCHEMBL21180572 0.89 KDM4E (0.45) MAPTKDM4EHPGDALDH1A1MEN1
SCHEMBL21180646 0.89 KDM4E (0.45) MAPTKDM4EHPGDALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10361380-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2019-07-23 US disclosed