SCHEMBL18998380

SCHEMBL18998380

CC1(C)c2ccccc2-c2cc(-c3cccc(-c4ccc(N(c5ccccc5)c5ccc(-c6ccccc6)cc5)cc4)c3)ccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 9/20 0.38
L3MBTL1 Q9Y468 3/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
RARA P10276 1/20 0.35
RARB P10826 1/20 0.35
RARG P13631 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ATM Q13315 2/20 0.35
APAF1 O14727 1/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL13700819 0.99 PDK2 (0.39) PDK2L3MBTL1MAPTALDH1A1KDM4E
SCHEMBL22182473 0.97 PDK2 (0.37) PDK2L3MBTL1MAPTALDH1A1KDM4E
SCHEMBL22182472 0.96 PDK2 (0.38) PDK2L3MBTL1MAPTALDH1A1KDM4E
SCHEMBL22182476 0.96 PDK2 (0.38) PDK2L3MBTL1MAPTALDH1A1KDM4E
SCHEMBL17931565 0.96 PDK2 (0.41) PDK2L3MBTL1MAPTALDH1A1KDM4E
SCHEMBL17690134 0.96 PDK2 (0.41) PDK2L3MBTL1MAPTALDH1A1KDM4E
SCHEMBL17931564 0.96 PDK2 (0.41) PDK2L3MBTL1MAPTALDH1A1KDM4E
SCHEMBL18998399 0.96 L3MBTL1 (0.39) PDK2L3MBTL1MAPTALDH1A1KDM4E
SCHEMBL14681479 0.96 L3MBTL1 (0.39) PDK2L3MBTL1MAPTALDH1A1KDM4E
SCHEMBL18802585 0.96 L3MBTL1 (0.39) PDK2L3MBTL1MAPTALDH1A1KDM4E

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-20170179416-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-22 US disclosed
US-20170179416-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-22 US disclosed