SCHEMBL19061497

SCHEMBL19061497

CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4ccc5c6ccccc6n(-c6ccc(-c7cc(-c8ccccc8)nc(-c8ccccc8)c7)cc6)c5c4)c3)cc21

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 13/20 0.36
▸ KDM4E B2RXH2 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ ATM Q13315 1/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ RXRA P19793 1/20 0.32
▸ RXRB P28702 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ FLT3 P36888 1/20 0.31
▸ ACACA Q13085 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
SCHEMBL19061282 0.98 PDK2 (0.37) PDK2KDM4EL3MBTL1ATMHDAC4
SCHEMBL19061537 0.95 KDM4E (0.34) PDK2KDM4EL3MBTL1ATMHDAC4
SCHEMBL19061510 0.94 PDK2 (0.34) PDK2KDM4EL3MBTL1ATMRXRA
SCHEMBL19061212 0.94 PDK2 (0.36) PDK2KDM4EL3MBTL1ATMHDAC4
SCHEMBL19061318 0.93 PDK2 (0.35) PDK2KDM4EL3MBTL1ATMRXRA
SCHEMBL8735313 0.93 KDM4E (0.37) PDK2KDM4EL3MBTL1ATMHDAC4
SCHEMBL19061253 0.92 PDK2 (0.37) PDK2KDM4EL3MBTL1ATMHDAC4
SCHEMBL14426157 0.92 KDM4E (0.36) PDK2KDM4EL3MBTL1ATMHDAC4
SCHEMBL19061303 0.91 PDK2 (0.35) PDK2KDM4EL3MBTL1ATMHDAC4
SCHEMBL15887945 0.91 PDK2 (0.34) PDK2KDM4EL3MBTL1ATMHDAC4

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
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