SCHEMBL19061537

SCHEMBL19061537

CC1(C)c2ccccc2-c2ccc(-c3ccccc3-c3ccc4c5ccccc5n(-c5ccc(-c6cc(-c7ccccc7)nc(-c7ccccc7)c6)cc5)c4c3)cc21

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ ATM Q13315 1/20 0.34
▸ PDK2 Q15119 3/20 0.34
▸ HDAC4 P56524 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ RXRA P19793 1/20 0.31
▸ RXRB P28702 1/20 0.31
▸ ACACA Q13085 1/20 0.31
▸ AKR1C4 P17516 1/20 0.30
▸ AKR1C3 P42330 1/20 0.30
▸ AKR1C2 P52895 1/20 0.30
▸ AKR1C1 Q04828 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 0.97 PDK2 (0.37) KDM4EL3MBTL1ATMPDK2HDAC4
SCHEMBL19061497 0.95 PDK2 (0.36) KDM4EL3MBTL1ATMPDK2HDAC4
SCHEMBL19061799 0.94 KDM4E (0.34) KDM4EL3MBTL1ATMPDK2HDAC4
SCHEMBL8735313 0.94 KDM4E (0.37) KDM4EL3MBTL1ATMPDK2HDAC4
SCHEMBL19061531 0.93 PDK2 (0.32) KDM4EL3MBTL1ATMPDK2MEN1
SCHEMBL17809339 0.91 KDM4E (0.33) KDM4EL3MBTL1ATMPDK2HDAC4
SCHEMBL17245616 0.91 KDM4E (0.35) KDM4EL3MBTL1ATMPDK2HDAC4
SCHEMBL17245793 0.91 KDM4E (0.35) KDM4EL3MBTL1ATMPDK2HDAC4
SCHEMBL19061253 0.91 PDK2 (0.37) KDM4EL3MBTL1ATMPDK2HDAC4
SCHEMBL19061317 0.91 KDM4E (0.35) KDM4EL3MBTL1ATMPDK2HDAC4

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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