SCHEMBL8423943

SCHEMBL8423943

COc1ccccc1NC=C1C(=O)N(c2ccc(C(=O)ONc3ccccc3OC)cc2)N=C1C

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
AMY1A P0DUB6 1/20 0.47
KMT2A Q03164 6/20 0.46
MEN1 O00255 5/20 0.46
KAT8 Q9H7Z6 6/20 0.45
POLB P06746 4/20 0.44
SIRT5 Q9NXA8 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
EP300 Q09472 3/20 0.42
ALDH1A1 P00352 3/20 0.42
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
MAPK1 P28482 2/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
RECQL P46063 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL8427629 0.89 FNTA (0.45) GAAAMY1AKMT2AMEN1KAT8
SCHEMBL8008711 0.88 KAT8 (0.59) GAAAMY1AKMT2AMEN1KAT8
SCHEMBL6947870 0.88 KAT8 (0.59) GAAAMY1AKMT2AMEN1KAT8
SCHEMBL8425625 0.87 FNTA (0.42) GAAAMY1AKMT2AMEN1KAT8
SCHEMBL8425820 0.87 MEN1 (0.44) GAAAMY1AKMT2AMEN1KAT8
SCHEMBL8011329 0.84 GAA (0.65) GAAAMY1AKMT2AMEN1POLB
SCHEMBL6945888 0.84 GAA (0.65) GAAAMY1AKMT2AMEN1POLB
SCHEMBL8427524 0.84 KAT8 (0.44) KMT2AMEN1KAT8POLBL3MBTL1
SCHEMBL8423941 0.83 KMT2A (0.54) GAAAMY1AKMT2AMEN1KAT8
SCHEMBL8424086 0.83 KAT8 (0.44) KMT2AMEN1KAT8POLBL3MBTL1

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
US-5869516-A 4-(arylaminomethylene)-2,4-dihydro-3-pyrazolones MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1999-02-09 US disclosed