SCHEMBL5536675

SCHEMBL5536675

COc1ccc(Br)cc1[C@H](Br)CO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
ALOX15 P16050 1/20 0.40
CASP1 P29466 1/20 0.40
HTT P42858 1/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ADRA2A P08913 1/20 0.39
ADRA1A P35348 1/20 0.39
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39

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
SCHEMBL16294121 0.83 GLA (0.42) KDM4ETDP1ALDH1A1MEN1USP2
SCHEMBL17700618 0.83 GLA (0.42) KDM4ETDP1ALDH1A1MEN1USP2
SCHEMBL16306959 0.83 GLA (0.42) KDM4ETDP1ALDH1A1MEN1USP2
SCHEMBL16960018 0.81 KDM4E (0.39) KDM4ETDP1ALDH1A1MEN1USP2
SCHEMBL2061830 0.80 GAA (0.41) KDM4ETDP1ALDH1A1MEN1USP2
SCHEMBL27885171 0.78 LMNA (0.42) KDM4ETDP1ALDH1A1GAAL3MBTL1
SCHEMBL12363071 0.78 LMNA (0.38) KDM4ETDP1ALDH1A1MEN1USP2
SCHEMBL7426724 0.77 ADRA2A (0.45) KDM4ETDP1ALDH1A1MEN1BLM
SCHEMBL3988110 0.77 ADRA2A (0.45) KDM4ETDP1ALDH1A1MEN1BLM
SCHEMBL82671 0.76 ADRA1A (0.50) KDM4ETDP1ALDH1A1MEN1USP2

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-1805164-A2 6-(PYRIDINYL)-4-PYRIMIDONE DERIVATES AS TAU PROTEIN KINASE 1 INHIBITORS Mitsubishi Pharma Corporation (JP) 2007-07-11 EP disclosed
WO-2006036015-A2 6- (PYRIDINYL) -4-PYRIMIDONE DERIVATES AS TAU PROTEIN KINASE 1 INHIBITORS MITSUBISHI PHARMA CORPORATION (JP) 2006-04-06 WO disclosed