SCHEMBL21277129

SCHEMBL21277129

c1ccc(-c2cc(-c3cccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6cccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)c6)cc5c34)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
MAPT P10636 5/20 0.36
ALDH1A1 P00352 4/20 0.36
HPGD P15428 4/20 0.36
KDM4E B2RXH2 4/20 0.35
LMNA P02545 3/20 0.35
GLA P06280 1/20 0.35
NTSR1 P30989 1/20 0.33
PLA2G2A P14555 2/20 0.32
PLA2G4A P47712 2/20 0.32
PLA2G10 O15496 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
ATM Q13315 1/20 0.32
PTGER4 P35408 1/20 0.31
PDE10A Q9Y233 1/20 0.31
MAOB P27338 2/20 0.31
MAOA P21397 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
CYP1A2 P05177 1/20 0.31

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
SCHEMBL17252754 0.96 KDM4E (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19239421 0.94 CHEK2 (0.33) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19239422 0.94 PDE10A (0.34) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL26169292 0.94 PLA2G2A (0.32) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19239423 0.93 CHEK2 (0.32) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL26169360 0.93 PLA2G2A (0.31) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19129977 0.93 PLA2G2A (0.33) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17252858 0.92 KDM4E (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19039054 0.92 KDM4E (0.35) ALDH1A1HPGDKDM4EPLA2G2APLA2G4A
SCHEMBL26169278 0.91 KDM4E (0.34) MEN1KMT2AMAPTALDH1A1HPGD

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
EP-3140302-B1 MATERIALS FOR ORGANIC LIGHT EMITTING DEVICES MERCK PATENT GMBH (DE) 2019-08-21 EP disclosed