SCHEMBL18960937

SCHEMBL18960937

c1ccc2c(c1)Oc1cccc(-c3nc(-c4ccc5oc6ccccc6c5c4)nc(-c4ccc5c6ccccc6c6ccccc6c5c4)n3)c1O2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 1/20 0.36
MAPT P10636 4/20 0.36
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 4/20 0.36
HPGD P15428 4/20 0.36
NPC1 O15118 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
RAB9A P51151 2/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
ALOX5 P09917 2/20 0.35
AHR P35869 3/20 0.33
HSD17B10 Q99714 2/20 0.32
CASP3 P42574 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
LMNA P02545 1/20 0.32
PDE10A Q9Y233 2/20 0.32

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
SCHEMBL18960954 0.93 ALOX5 (0.43) CHEK2MAPTKDM4EALDH1A1HPGD
SCHEMBL18960942 0.90 CHEK2 (0.35) CHEK2MAPTKDM4EALDH1A1HPGD
SCHEMBL18960935 0.88 ALDH1A1 (0.36) MAPTKDM4EALDH1A1HPGDNPC1
SCHEMBL18960966 0.86 AHR (0.34) KDM4EAHR
SCHEMBL18960962 0.85 ALOX5 (0.42) CHEK2MAPTKDM4EALDH1A1HPGD
SCHEMBL18961061 0.85 MAPT (0.38) CHEK2MAPTKDM4EALDH1A1HPGD
SCHEMBL18960951 0.82 ALOX5 (0.33) MAPTALDH1A1HPGDSMN1; SMN2RAB9A
SCHEMBL25581475 0.81 KDM4E (0.39) CHEK2MAPTKDM4EALDH1A1HPGD
SCHEMBL25581326 0.81 ALOX5 (0.49) CHEK2MAPTKDM4EALDH1A1HPGD
SCHEMBL18960952 0.81 CHEK2 (0.36) CHEK2MAPTKDM4EALDH1A1HPGD

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-20170170405-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-15 US disclosed
US-20170170405-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-15 US disclosed