SCHEMBL27283462

SCHEMBL27283462

c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(C45c6ccccc6C(c6ccccc64)c4ccccc45)n3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.41
▸ KMT2A Q03164 7/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ HPGD P15428 2/20 0.41
▸ ADORA2A P29274 4/20 0.39
▸ ADORA1 P30542 3/20 0.39
▸ ADORA3 P0DMS8 2/20 0.39
▸ ADORA2B P29275 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ LMNA P02545 3/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ ATM Q13315 1/20 0.36
▸ GLA P06280 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ CYP3A4 P08684 1/20 0.35
▸ TAAR1 Q96RJ0 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ TDP1 Q9NUW8 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
SCHEMBL27281980 0.97 ADORA2A (0.41) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL27281970 0.93 MEN1 (0.40) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL27281966 0.93 MEN1 (0.43) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL27287100 0.86 L3MBTL1 (0.47) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL27287579 0.86 L3MBTL1 (0.47) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL27284685 0.85 MEN1 (0.39) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL27284791 0.84 TSHR (0.36) MEN1KMT2AALDH1A1MAPTADORA2A
SCHEMBL27284573 0.84 HRH4 (0.40) —
SCHEMBL27284890 0.83 ADORA2A (0.44) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL27284782 0.82 ADORA2A (0.33) 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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