SCHEMBL19061994

SCHEMBL19061994

CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4ccc5c6ccccc6n(-c6cccc(-c7nc(-c8ccccc8)nc(-c8ccc(-c9ccccc9)cc8)n7)c6)c5c4)cc3)cc21

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 1/20 0.34
▸ PDK2 Q15119 5/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ RXRA P19793 1/20 0.32
▸ RXRB P28702 1/20 0.32
▸ AVPR1A P37288 1/20 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
▸ 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
SCHEMBL19061276 1.00 PDE10A (0.34) PDE10APDK2KDM4EATML3MBTL1
SCHEMBL19061500 0.99 PDE10A (0.33) PDE10APDK2KDM4EATML3MBTL1
SCHEMBL19037015 0.99 KDM4E (0.34) PDE10APDK2KDM4EATML3MBTL1
SCHEMBL19061448 0.98 KDM4E (0.33) PDE10APDK2KDM4EATML3MBTL1
SCHEMBL18385166 0.97 PDE10A (0.33) PDE10APDK2KDM4EATML3MBTL1
SCHEMBL17714885 0.97 KDM4E (0.35) PDE10APDK2KDM4EATML3MBTL1
SCHEMBL18385196 0.97 PDE10A (0.33) PDE10APDK2KDM4EATML3MBTL1
SCHEMBL19061544 0.97 KDM4E (0.33) PDE10APDK2KDM4EATML3MBTL1
SCHEMBL18385181 0.97 PDE10A (0.33) PDE10APDK2KDM4EATML3MBTL1
SCHEMBL18385527 0.96 KDM4E (0.33) PDE10AKDM4EATML3MBTL1RXRA

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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