SCHEMBL18848486

SCHEMBL18848486

Ic1nc(-c2cccc(-c3ccccc3)c2)cc(-c2cccc(-c3ccccc3)c2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.47
KMT2A Q03164 7/20 0.47
MAPT P10636 5/20 0.47
ALDH1A1 P00352 4/20 0.47
HPGD P15428 4/20 0.47
KDM4E B2RXH2 2/20 0.47
LMNA P02545 2/20 0.47
ADORA2A P29274 1/20 0.47
ADORA1 P30542 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KMO O15229 2/20 0.44
GLA P06280 1/20 0.43
RAB9A P51151 1/20 0.43
AGTR1 P30556 1/20 0.42
TSHR P16473 1/20 0.42
ATM Q13315 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CYP1A1 P04798 1/20 0.42
CYP1B1 Q16678 1/20 0.42

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
SCHEMBL21310211 0.98 MEN1 (0.50) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19417179 0.87 MEN1 (0.56) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL25323 0.87 MEN1 (0.60) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL13113796 0.85 MEN1 (0.57) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17721019 0.83 MEN1 (0.60) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL21563962 0.83 MEN1 (0.66) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL18134339 0.83 MEN1 (0.66) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL18818699 0.81 AURKA (0.46) MEN1KMT2AMAPTKDM4EADORA2A
SCHEMBL20371056 0.81 MEN1 (0.50) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL18134366 0.81 MEN1 (0.63) 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
US-20170133599-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-11 US disclosed