SCHEMBL18839982

SCHEMBL18839982

C1=CC(c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)CC=C1c1nc(-c2ccccc2)nc(-c2ccccc2)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ MEN1 O00255 5/20 0.36
▸ KMT2A Q03164 5/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ ADORA2A P29274 2/20 0.33
▸ ADORA1 P30542 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ ADORA2B P29275 1/20 0.33
▸ NTSR1 P30989 1/20 0.33
▸ ATM Q13315 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ GLA P06280 1/20 0.32
▸ KDM1A O60341 3/20 0.31
▸ HTT P42858 2/20 0.31
▸ MAOB P27338 1/20 0.31
▸ TDP1 Q9NUW8 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
SCHEMBL18863457 0.95 L3MBTL1 (0.36) L3MBTL1MEN1KMT2AALDH1A1MAPT
SCHEMBL25740757 0.86 MEN1 (0.32) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL25740758 0.86 MEN1 (0.32) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL22688523 0.85 MEN1 (0.31) L3MBTL1MEN1KMT2AALDH1A1MAPT
SCHEMBL20065674 0.84 SORD (0.31) L3MBTL1HTT
SCHEMBL24907909 0.83 NPC1 (0.32) L3MBTL1MEN1KMT2AMAPTPOLB
SCHEMBL19368630 0.82 LIMK1 (0.33) —
SCHEMBL26224719 0.81 MEN1 (0.31) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL24283385 0.81 MEN1 (0.32) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL24656680 0.81 BACE1 (0.34) ALDH1A1MAPTPOLBKDM4ELMNA

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-2017081074-A1 METALLIC LAYER COMPRISING ALKALI METAL AND SECOND METAL NOVALED GMBH (DE) 2017-05-18 — — WO disclosed
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