SCHEMBL17944296

SCHEMBL17944296

CC1(C)c2cc(-c3ccc4c(c3)oc3ccc5ccccc5c34)ccc2-c2ccc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccccc34)cc21

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 4/20 0.34
AHR P35869 3/20 0.33
PSD A5PKW4 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
PAX8 Q06710 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
MEN1 O00255 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 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
SCHEMBL19109955 0.93 TDP1 (0.33) ABCG2PSDTDP1MAOAMAOB
SCHEMBL20127595 0.93 ABCG2 (0.34) ABCG2AHRNPC1RAB9APAX8
SCHEMBL17944292 0.93 ABCG2 (0.34) ABCG2AHRNPC1RAB9APAX8
SCHEMBL20127575 0.92 ABCG2 (0.35) ABCG2AHRNPC1RAB9APAX8
SCHEMBL19080953 0.92 ABCG2 (0.34) ABCG2AHRNPC1RAB9APAX8
SCHEMBL19081746 0.92
SCHEMBL10122702 0.92 ABCG2 (0.34) ABCG2AHRNPC1RAB9APAX8
SCHEMBL10122700 0.92 ABCG2 (0.34) ABCG2AHRNPC1RAB9APAX8
SCHEMBL19080687 0.92 ABCG2 (0.34) ABCG2AHRNPC1RAB9APAX8
SCHEMBL20127585 0.92 ABCG2 (0.34) ABCG2AHRNPC1RAB9APAX8

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-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