SCHEMBL17931997

SCHEMBL17931997

CC1(C)c2ccccc2-c2cc(-c3c4ccccc4c(-c4cccc5c4ccc4oc6ccccc6c45)c4ccccc34)ccc21

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 1/20 0.32
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
KMT2A Q03164 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
ALOX5 P09917 1/20 0.32
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
MAOB P27338 1/20 0.30

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
SCHEMBL19109864 0.94 MEN1 (0.35) ALKKDM4EMEN1ALDH1A1MAPT
SCHEMBL21729917 0.92 ALK (0.34) ALKKDM4EMEN1ALDH1A1MAPT
SCHEMBL24342947 0.90 ALK (0.30) ALK
SCHEMBL24341660 0.90 ALK (0.31) ALKKDM4EMEN1ALDH1A1MAPT
SCHEMBL23502139 0.90 HSP90AA1 (0.32) ALKKDM4EMEN1ALDH1A1MAPT
SCHEMBL17932183 0.89 HSP90AA1 (0.34) ALKKDM4EMEN1ALDH1A1MAPT
SCHEMBL24341091 0.89 ALOX5 (0.36) ALKKDM4EMEN1ALDH1A1MAPT
SCHEMBL19076556 0.87 ALK (0.32) ALKKDM4EMEN1ALDH1A1MAPT
SCHEMBL19109564 0.87
SCHEMBL19076552 0.87 ALOX5 (0.31) ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160218297-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-28 US disclosed
US-20160218297-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-28 US disclosed
EP-3048654-A2 ORGANIC LIGHT-EMITTING DEVICE Samsung Display Co., Ltd. (KR) 2016-07-27 EP disclosed
US-20160211454-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-21 US disclosed
US-20160211454-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-21 US disclosed