SCHEMBL29610924

SCHEMBL29610924

COc1ccc(CNc2ncnc3c2c(Br)cn3[C@@H]2O[C@H](C(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)[C@H]3OC(C)(C)O[C@H]32)c(OC)c1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 2/20 0.38
▸ EPHX2 P34913 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ SRC P12931 2/20 0.35
▸ PRMT5 O14744 1/20 0.35
▸ METTL3 Q86U44 1/20 0.35
▸ WDR77 Q9BQA1 1/20 0.35
▸ ABL1 P00519 1/20 0.35
▸ EGFR P00533 1/20 0.35
▸ ABL2 P42684 1/20 0.35
▸ STS P08842 1/20 0.35
▸ ADORA1 P30542 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ CCRL2 O00421 1/20 0.34
▸ DNMT3A Q9Y6K1 1/20 0.33

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
SCHEMBL24314225 1.00 ADORA3 (0.38) ADORA3EPHX2MAPTSRCPRMT5
SCHEMBL24313535 0.91 ADORA3 (0.40) ADORA3PRMT5METTL3WDR77
SCHEMBL29610818 0.91 ADORA3 (0.40) ADORA3PRMT5METTL3WDR77
SCHEMBL29611495 0.90 METTL3 (0.47) PRMT5METTL3WDR77
SCHEMBL24314226 0.90 METTL3 (0.47) PRMT5METTL3WDR77
SCHEMBL24313565 0.84 ADORA3 (0.43) ADORA3MAPTALDH1A1
SCHEMBL29610857 0.84 ADORA3 (0.43) ADORA3MAPTALDH1A1
SCHEMBL24313864 0.84 ADORA3 (0.43) ADORA3MAPTALDH1A1
SCHEMBL29611653 0.84 ADORA3 (0.43) ADORA3MAPTALDH1A1
SCHEMBL30642217 0.83 PRMT5 (0.45) PRMT5METTL3WDR77

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4229067-A1 METTL3 MODULATORS Accent Therapeutics, Inc. (US) 2023-08-23 — — EP disclosed
WO-2022081739-A1 METTL3 MODULATORS ACCENT THERAPEUTICS, INC. (US) 2022-04-21 — — WO disclosed
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