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SCHEMBL22058809

SCHEMBL22058809

C1=Cc2c(n(-c3ccccc3)c3cccc(-c4ccc(-c5nc(-c6ccccc6)cc(-c6ccccc6)n5)cc4-c4nc(-c5ccccc5)cc(-c5ccccc5)n4)c23)CC1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.33
▸ KMT2A Q03164 4/20 0.33
▸ HPGD P15428 4/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ MAPT P10636 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ NTSR1 P30989 1/20 0.32
▸ GLA P06280 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
SCHEMBL21320073 0.86 ALDH1A1 (0.33) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL21320518 0.85 KDM4E (0.32) HPGDALDH1A1MAPTKDM4E
SCHEMBL21319865 0.84 KDM4E (0.31) HPGDALDH1A1MAPTKDM4E
SCHEMBL14232820 0.82 KMT2A (0.42) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL21320456 0.81 KDM4E (0.31) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL26242339 0.80 KDM4E (0.31) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL22058285 0.80 KDM4E (0.40) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL25748195 0.80 PRKDC (0.30) —
SCHEMBL20041285 0.79 KMT2A (0.38) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL21320331 0.79 KDM4E (0.33) KDM4E

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-2020111585-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-06-04 — — WO disclosed
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