SCHEMBL22742986

SCHEMBL22742986

CC(CCC(=O)Nc1cccc(Br)c1)ON1C(=O)c2ccccc2C1=O

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.48
▸ SMN1; SMN2 Q16637 5/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ HPGD P15428 2/20 0.46
▸ MAPT P10636 2/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ POLB P06746 1/20 0.44
▸ PRMT5 O14744 1/20 0.43
▸ WDR77 Q9BQA1 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ HDAC4 P56524 1/20 0.43
▸ MEF2D Q14814 1/20 0.43
▸ PTPRC P08575 1/20 0.43

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
SCHEMBL21684122 0.83 GAA (0.54) GAASMN1; SMN2ALDH1A1HPGDMAPT
SCHEMBL22743025 0.79 GAA (0.49) GAASMN1; SMN2ALDH1A1HPGDMAPT
SCHEMBL22743033 0.79 SMN1; SMN2 (0.52) GAASMN1; SMN2ALDH1A1HPGDMAPT
SCHEMBL22742984 0.76 GAA (0.63) GAASMN1; SMN2ALDH1A1HPGDMAPT
SCHEMBL22743379 0.75 SMN1; SMN2 (0.51) GAASMN1; SMN2ALDH1A1MAPTL3MBTL1
SCHEMBL22743591 0.75 SMN1; SMN2 (0.51) GAASMN1; SMN2ALDH1A1MAPTL3MBTL1
SCHEMBL21682036 0.75 POLB (0.69) SMN1; SMN2ALDH1A1HPGDMAPTKDM4E
SCHEMBL24137556 0.74 KMT2A (0.71) GAASMN1; SMN2ALDH1A1MAPTKDM4E
SCHEMBL22743019 0.74 POLB (0.74) GAASMN1; SMN2ALDH1A1HPGDMAPT
SCHEMBL22743592 0.72 SMN1; SMN2 (0.52) GAASMN1; SMN2ALDH1A1HPGDMAPT

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-2020243178-A1 HETEROCYCLIC COMPOUNDS AS PRMT5 INHIBITORS ANGEX PHARMACEUTICAL, INC. (US) 2020-12-03 — — WO disclosed
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