SCHEMBL21023529

SCHEMBL21023529

C1=CCCC(c2cc(-c3ccc4c(c3)oc3ccccc34)nc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5cccc(-c6ccccc6)c5)n4)c3)n2)=C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.37
KMT2A Q03164 7/20 0.37
MAPT P10636 5/20 0.37
ALDH1A1 P00352 5/20 0.37
HPGD P15428 4/20 0.37
KDM4E B2RXH2 4/20 0.37
LMNA P02545 3/20 0.37
GLA P06280 1/20 0.37
HCRTR1 O43613 1/20 0.34
MMP12 P39900 1/20 0.34
MMP13 P45452 1/20 0.34
PLA2G2A P14555 3/20 0.33
PLA2G4A P47712 3/20 0.33
NTSR1 P30989 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
ATM Q13315 1/20 0.32
PLA2G10 O15496 1/20 0.32
TTR P02766 1/20 0.32
ADORA2A P29274 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
SCHEMBL14052185 0.88 MEN1 (0.34) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22664865 0.87 MEN1 (0.38) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22309579 0.86 MEN1 (0.48) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL21023967 0.86 MEN1 (0.48) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL21023976 0.86 MEN1 (0.48) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22308822 0.86 MEN1 (0.48) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL21023536 0.86 MEN1 (0.48) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22308625 0.86 MEN1 (0.48) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL21140350 0.86 MEN1 (0.48) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22309577 0.86 MEN1 (0.48) 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-3486299-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE Samsung SDI Co., Ltd. (KR) 2019-05-22 EP disclosed