SCHEMBL14644221

SCHEMBL14644221

CBc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ MEN1 O00255 6/20 0.47
▸ KMT2A Q03164 6/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ MAPT P10636 3/20 0.47
▸ HPGD P15428 3/20 0.47
▸ POLB P06746 1/20 0.45
▸ ADORA3 P0DMS8 1/20 0.45
▸ ADORA2A P29274 1/20 0.45
▸ ADORA2B P29275 1/20 0.45
▸ ADORA1 P30542 1/20 0.45
▸ ATM Q13315 1/20 0.44
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ NR1H2 P55055 2/20 0.42
▸ NR1H3 Q13133 2/20 0.42
▸ NTSR1 P30989 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ LMNA P02545 4/20 0.41
▸ HTT P42858 1/20 0.41

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
SCHEMBL14307277 0.87 MEN1 (0.58) L3MBTL1MEN1KMT2AALDH1A1MAPT
SCHEMBL14492415 0.84 ALDH1A1 (0.50) ALDH1A1MAPTMAPK1CYP1A2CYP1A1
SCHEMBL14307276 0.81 MEN1 (0.51) L3MBTL1MEN1KMT2AALDH1A1MAPT
SCHEMBL24449154 0.81 L3MBTL1 (0.54) L3MBTL1MEN1KMT2AALDH1A1MAPT
SCHEMBL18212420 0.81 L3MBTL1 (0.70) L3MBTL1MEN1KMT2AALDH1A1MAPT
SCHEMBL6112014 0.81 L3MBTL1 (0.70) L3MBTL1MEN1KMT2AALDH1A1MAPT
SCHEMBL21975473 0.78 L3MBTL1 (0.50) L3MBTL1MEN1KMT2AALDH1A1MAPT
SCHEMBL12636103 0.78 L3MBTL1 (0.67) L3MBTL1MEN1KMT2AALDH1A1MAPT
SCHEMBL15894213 0.78 L3MBTL1 (0.67) L3MBTL1MEN1KMT2AALDH1A1MAPT
SCHEMBL13492067 0.78 L3MBTL1 (0.67) L3MBTL1MEN1KMT2AALDH1A1MAPT

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-2013009013-A2 NOVEL COMPOUND AND ORGANIC ELECTRONIC DEVICE USING SAME 주식회사 엘지화학 (KR) 2013-01-17 — — WO disclosed
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