SCHEMBL20616082

SCHEMBL20616082

CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4c5cc6c(cc5n(-c5ccccc5)c4c3)C(C)(C)c3ccccc3-6)cc21

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.33
PGR P06401 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL20616073 0.98 PGR (0.33) PDK2PGRKDM4EATML3MBTL1
SCHEMBL15582981 0.95 PGR (0.31) PDK2PGR
SCHEMBL20616083 0.95 PGR (0.30) PDK2PGR
SCHEMBL802076 0.94 KDM4E (0.39) PDK2PGRKDM4EATML3MBTL1
SCHEMBL16773398 0.94 PDK2 (0.30) PDK2KDM4EATML3MBTL1
SCHEMBL20616087 0.94 PGR (0.31) PGRKDM4EATML3MBTL1
SCHEMBL20616075 0.94 PGR (0.31) PGRKDM4EATML3MBTL1
SCHEMBL20616088 0.93 PDK2 (0.31) PDK2
SCHEMBL20616074 0.93 PDK2 (0.30) PDK2
SCHEMBL22901107 0.92 KDM4E (0.36) PDK2KDM4EATML3MBTL1

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
WO-2019004617-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2019-01-03 WO disclosed