SCHEMBL5808255

SCHEMBL5808255

CC(C)C(=O)C(=Cc1ccc(Br)cc1)C(=O)Nc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
MAPT P10636 8/20 0.46
MEN1 O00255 7/20 0.46
KMT2A Q03164 7/20 0.46
ALDH1A1 P00352 4/20 0.46
LMNA P02545 4/20 0.46
HTT P42858 2/20 0.46
MAPK1 P28482 2/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 1/20 0.46
HPGD P15428 1/20 0.46
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA7 P43166 1/20 0.44
RAB9A P51151 4/20 0.43
NPC1 O15118 3/20 0.43
GAA P10253 1/20 0.43
TDP1 Q9NUW8 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
SCHEMBL5808254 1.00 MAOA (0.46) MAOAMAOBMAPTMEN1KMT2A
SCHEMBL6695821 0.90 MAPT (0.55) MAOAMAOBMAPTMEN1KMT2A
SCHEMBL927020 0.90 MAPT (0.55) MAOAMAOBMAPTMEN1KMT2A
SCHEMBL10045756 0.90 MAPT (0.55) MAOAMAOBMAPTMEN1KMT2A
SCHEMBL6769185 0.88 ALDH1A1 (0.55) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL6763984 0.88 MAPT (0.55) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL6769183 0.88 ALDH1A1 (0.55) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL6763989 0.88 MAPT (0.55) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL5464812 0.84 TAAR1 (0.46) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL5464816 0.84 TAAR1 (0.46) MAPTMEN1KMT2AALDH1A1LMNA

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-2006110918-A1 PYRROLE COMPOUNDS AND USES THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2006-10-19 WO disclosed