SCHEMBL19061305

SCHEMBL19061305

CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)c3)cc21

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ DUSP3 P51452 1/20 0.36
▸ PDK2 Q15119 8/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.33
▸ PGR P06401 3/20 0.33
▸ KMT2A Q03164 2/20 0.32
▸ IL1R1 P14778 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HTT P42858 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
SCHEMBL19061308 0.96 PDK2 (0.36) L3MBTL1KDM4EATMDUSP3PDK2
SCHEMBL19061861 0.96 KDM4E (0.36) L3MBTL1KDM4EATMDUSP3PDK2
SCHEMBL18963187 0.95 KDM4E (0.38) L3MBTL1KDM4EATMDUSP3PDK2
SCHEMBL19061327 0.94 KDM4E (0.39) L3MBTL1KDM4EATMDUSP3PDK2
SCHEMBL19061685 0.93 L3MBTL1 (0.36) L3MBTL1KDM4EATMDUSP3PDK2
SCHEMBL19061306 0.93 PDK2 (0.36) L3MBTL1KDM4EATMDUSP3PDK2
SCHEMBL19061314 0.93 DUSP3 (0.33) L3MBTL1KDM4EATMDUSP3PDK2
SCHEMBL19061435 0.92 ATM (0.35) L3MBTL1KDM4EATMDUSP3PDK2
SCHEMBL19061329 0.92 PDK2 (0.36) L3MBTL1KDM4EATMDUSP3PDK2
SCHEMBL19061708 0.92 KDM4E (0.39) L3MBTL1KDM4EATMDUSP3PDK2

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-2017111389-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DIODE INCLUDING SAME 주식회사 두산 2017-06-29 — — WO disclosed
Send feedback