SCHEMBL27287299

SCHEMBL27287299

c1ccc(-c2cc(-c3ccccc3)nc(C34c5ccccc5C(c5nc(-c6ccccc6)cc(-c6ccccc6)n5)(c5ccccc53)c3ccccc34)n2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 10/20 0.52
▸ KMT2A Q03164 10/20 0.52
▸ ALDH1A1 P00352 5/20 0.52
▸ HPGD P15428 4/20 0.52
▸ ADORA1 P30542 3/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ ADORA2A P29274 2/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ MAPT P10636 6/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ AGTR1 P30556 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ ATM Q13315 1/20 0.47
▸ NTSR1 P30989 1/20 0.46
▸ KDM4E B2RXH2 4/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ CYP1A1 P04798 1/20 0.42
▸ CYP1B1 Q16678 1/20 0.42
▸ ADORA3 P0DMS8 1/20 0.41

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
SCHEMBL27287303 0.96 MEN1 (0.48) MEN1KMT2AALDH1A1HPGDADORA1
SCHEMBL27287698 0.91 MEN1 (0.56) MEN1KMT2AALDH1A1HPGDADORA1
SCHEMBL27286884 0.91 MEN1 (0.44) MEN1KMT2AALDH1A1HPGDADORA1
SCHEMBL27287432 0.91 MEN1 (0.45) MEN1KMT2AALDH1A1HPGDADORA1
SCHEMBL27286887 0.88 AGTR1 (0.43) MEN1KMT2AALDH1A1HPGDADORA1
SCHEMBL27284893 0.84 MEN1 (0.40) MEN1KMT2AALDH1A1HPGDADORA1
SCHEMBL27286888 0.84 MEN1 (0.40) MEN1KMT2AALDH1A1HPGDADORA1
SCHEMBL27284890 0.83 ADORA2A (0.44) MEN1KMT2AALDH1A1HPGDADORA1
SCHEMBL27285166 0.83 MEN1 (0.39) MEN1KMT2AALDH1A1HPGDADORA1
SCHEMBL27285017 0.82 MEN1 (0.37) MEN1KMT2AALDH1A1HPGDADORA1

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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