SCHEMBL27282079

SCHEMBL27282079

c1ccc(-c2ccc3c(c2)C2(c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c4ccccc4C3(c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c3ccccc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.46
▸ KMT2A Q03164 8/20 0.46
▸ ALDH1A1 P00352 5/20 0.46
▸ MAPT P10636 5/20 0.46
▸ HPGD P15428 4/20 0.46
▸ NTSR1 P30989 1/20 0.42
▸ KDM4E B2RXH2 3/20 0.41
▸ LMNA P02545 3/20 0.41
▸ GLA P06280 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ ADORA2A P29274 2/20 0.40
▸ ADORA1 P30542 2/20 0.40
▸ PDK2 Q15119 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ ADORA3 P0DMS8 1/20 0.36
▸ ADORA2B P29275 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ NFKB1 P19838 1/20 0.35

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
SCHEMBL27287100 0.91 L3MBTL1 (0.47) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL27287579 0.91 L3MBTL1 (0.47) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL27282074 0.88 L3MBTL1 (0.41) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL27287202 0.88 L3MBTL1 (0.41) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21394301 0.85 PDK2 (0.45) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21394296 0.85 PDK2 (0.45) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21868610 0.85 PDK2 (0.45) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21394299 0.85 PDK2 (0.45) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21394151 0.85 PDK2 (0.45) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL27287698 0.85 MEN1 (0.56) 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-2024013004-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2024-01-18 — — WO disclosed
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