SCHEMBL31553016

SCHEMBL31553016

O=[N+]([O-])c1c(F)cncc1Br

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.36
▸ PKM P14618 1/20 0.36
▸ MAPK1 P28482 2/20 0.35
▸ VCP P55072 1/20 0.32
▸ TDP1 Q9NUW8 2/20 0.31
▸ GAA P10253 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ GRIN2D O15399 2/20 0.31
▸ GRIN3B O60391 2/20 0.31
▸ GRIN1 Q05586 2/20 0.31
▸ GRIN2A Q12879 2/20 0.31
▸ GRIN2B Q13224 2/20 0.31
▸ GRIN2C Q14957 2/20 0.31
▸ GRIN3A Q8TCU5 2/20 0.31
▸ AAK1 Q2M2I8 1/20 0.31
▸ RIPK1 Q13546 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL12835616 0.85 MAPT (0.36) MAPTMAPK1TDP1GAAHTT
SCHEMBL31553067 0.76 ALDH1A1 (0.42) MAPTPKMTDP1L3MBTL1GRIN2D
SCHEMBL17555458 0.76 ALDH1A1 (0.36) MAPTPKMTDP1HTTAAK1
SCHEMBL29071382 0.76 GPR35 (0.37) MAPTGAAHTTGRIN2DGRIN3B
SCHEMBL29301459 0.76 ALDH1A1 (0.42) MAPTPKMMAPK1TDP1GAA
SCHEMBL31553071 0.73 GRIN2D (0.35) MAPTTDP1GAAHTTGRIN2D
SCHEMBL20594965 0.72 ALDH1A1 (0.38) MAPTPKMMAPK1TDP1GAA
SCHEMBL31553080 0.72 GRIN2D (0.32) MAPTMAPK1TDP1GRIN2DGRIN3B
SCHEMBL14246396 0.69 MAPT (0.40) MAPTPKMMAPK1VCPTDP1
SCHEMBL9000095 0.69 ATM (0.44) MAPTPKMMAPK1VCPTDP1

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-2025061035-A1 BRM SELECTIVE DEGRADATION AGENT COMPOUND AND USE THEREOF 南京再明医药有限公司 2025-03-27 — — WO disclosed
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