SCHEMBL18560741

SCHEMBL18560741

Cc1ccc(-c2cc(-c3ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 4/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ATM Q13315 1/20 0.37
PTGER4 P35408 1/20 0.36
ALDH1A1 P00352 9/20 0.35
RXFP1 Q9HBX9 1/20 0.35
AKR1C4 P17516 1/20 0.35
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
AKR1C1 Q04828 1/20 0.35
KDR P35968 1/20 0.35
MAPT P10636 2/20 0.34
HPGD P15428 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
NPC1 O15118 1/20 0.33
STAT1 P42224 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL18560773 0.97 MEN1 (0.37) MEN1KMT2AKDM4EL3MBTL1ATM
SCHEMBL18560737 0.92 KDM4E (0.37) MEN1KMT2AKDM4EL3MBTL1ATM
SCHEMBL14748592 0.91 MEN1 (0.46) MEN1KMT2AKDM4EL3MBTL1ATM
SCHEMBL18560770 0.89 KDM4E (0.35) MEN1KMT2AKDM4EL3MBTL1ATM
SCHEMBL18560748 0.89 L3MBTL1 (0.39) MEN1KMT2AKDM4EL3MBTL1ATM
SCHEMBL18560736 0.88 KDM4E (0.38) KMT2AKDM4EL3MBTL1ATMPTGER4
SCHEMBL14748528 0.88 MEN1 (0.43) MEN1KMT2AKDM4EL3MBTL1ATM
SCHEMBL14748520 0.88 MEN1 (0.43) MEN1KMT2AKDM4EL3MBTL1ATM
SCHEMBL15748607 0.87 L3MBTL1 (0.46) MEN1KMT2AKDM4EL3MBTL1ATM
SCHEMBL14212374 0.87 L3MBTL1 (0.46) MEN1KMT2AKDM4EL3MBTL1ATM

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
US-20170062730-A1 MULTI-COMPONENT HOST MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2017-03-02 US disclosed