SCHEMBL19061448

SCHEMBL19061448

CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4ccc5c6ccccc6n(-c6cccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)c6)c5c4)c3)cc21

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.32
▸ PDK2 Q15119 4/20 0.31
▸ GAA P10253 2/20 0.30
▸ ALDH1A1 P00352 2/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ RXRA P19793 1/20 0.30
▸ RXRB P28702 1/20 0.30
▸ RXFP1 Q9HBX9 1/20 0.30
▸ POLB P06746 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
SCHEMBL19061500 0.99 PDE10A (0.33) KDM4EATML3MBTL1PDE10APDK2
SCHEMBL17714885 0.99 KDM4E (0.35) KDM4EATML3MBTL1PDE10APDK2
SCHEMBL19037015 0.99 KDM4E (0.34) KDM4EATML3MBTL1PDE10APDK2
SCHEMBL19061994 0.98 PDE10A (0.34) KDM4EATML3MBTL1PDE10APDK2
SCHEMBL19061276 0.98 PDE10A (0.34) KDM4EATML3MBTL1PDE10APDK2
SCHEMBL26451244 0.98 KDM4E (0.32) KDM4EATML3MBTL1PDE10APDK2
SCHEMBL17714921 0.96 PTGER4 (0.34) KDM4EATML3MBTL1PDE10ARXFP1
SCHEMBL18385527 0.96 KDM4E (0.33) KDM4EATML3MBTL1PDE10AGAA
SCHEMBL18385199 0.96 KDM4E (0.33) KDM4EATML3MBTL1PDE10AGAA
SCHEMBL19061538 0.96 KDM4E (0.33) KDM4EATML3MBTL1PDE10AGAA

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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