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SCHEMBL19918684

SCHEMBL19918684

c1ccc(-c2cc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7oc8cc9c%10c(cccc%10c8c7c6)-c6ccccc6-9)ccc54)c3)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.33
▸ KMT2A Q03164 4/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ MAPT P10636 3/20 0.33
▸ HPGD P15428 3/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ LMNA P02545 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ NTSR1 P30989 1/20 0.32
▸ ATM Q13315 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ PTGER4 P35408 1/20 0.30
▸ PTGES O14684 1/20 0.30

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
SCHEMBL19918569 0.94 L3MBTL1 (0.33) ALDH1A1HPGDKDM4EATML3MBTL1
SCHEMBL19918567 0.90 HPSE (0.32) —
SCHEMBL19918540 0.90 RAC2 (0.31) —
SCHEMBL19918566 0.90 L3MBTL1 (0.33) ALDH1A1HPGDKDM4EATML3MBTL1
SCHEMBL19918436 0.90 ATM (0.36) ALDH1A1HPGDKDM4EATML3MBTL1
SCHEMBL19918434 0.90 ATM (0.36) ALDH1A1HPGDKDM4EATML3MBTL1
SCHEMBL19918686 0.89 — —
SCHEMBL19918435 0.89 ATM (0.35) ALDH1A1HPGDKDM4EATML3MBTL1
SCHEMBL21277129 0.88 MEN1 (0.36) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL19918690 0.87 MEN1 (0.36) MEN1KMT2AALDH1A1MAPTHPGD

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-2018038400-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING SAME 주식회사 두산 2018-03-01 — — WO disclosed