SCHEMBL846656

SCHEMBL846656

Cc1ccc(C(Br)C=O)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
LMNA P02545 2/20 0.33
HPGD P15428 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GABRB2 P47870 1/20 0.33
TRPA1 O75762 1/20 0.33
CHRM1 P11229 1/20 0.33
SLC6A2 P23975 1/20 0.33
ADRA1A P35348 1/20 0.33
HTR2B P41595 1/20 0.33
SRC P12931 1/20 0.33
TP53 P04637 1/20 0.32
HTT P42858 1/20 0.32
ALKBH3 Q96Q83 1/20 0.32
RAB9A P51151 2/20 0.31
MAPT P10636 2/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL9901514 0.85 ALKBH3 (0.35) GABRA1GABRG2GABRB3LMNAHPGD
SCHEMBL1961187 0.81 TP53 (0.47) LMNAALDH1A1TP53HTTMAPT
SCHEMBL21495096 0.81 TP53 (0.47) LMNAALDH1A1TP53HTTMAPT
SCHEMBL3413433 0.81 TDP1 (0.35) LMNAALDH1A1TRPA1CHRM1SLC6A2
SCHEMBL2932458 0.78 MDM2 (0.39) LMNAHPGDALDH1A1HTT
SCHEMBL20551407 0.78 MDM2 (0.39) LMNAHPGDALDH1A1HTT
SCHEMBL20550917 0.77 HTR2A (0.40) ALDH1A1HTTMAOAMAOB
SCHEMBL929896 0.77 LMNA (0.38) LMNAALDH1A1TRPA1CHRM1SLC6A2
SCHEMBL18103225 0.76 LMNA (0.42) GABRA1GABRG2GABRB3LMNAALDH1A1
SCHEMBL9751714 0.74 TRPA1 (0.43) LMNAHPGDALDH1A1TRPA1CHRM1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2432774-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR MODULATING URIC ACID LEVELS Ardea Biosciences, Inc. (US) 2012-03-28 EP disclosed
EP-2432468-A2 METHODS OF MODULATING URIC ACID LEVELS Ardea Biosciences, Inc. (US) 2012-03-28 EP disclosed
WO-2010135536-A2 METHODS OF MODULATING URIC ACID LEVELS ARDEA BIOSCIENCES, INC. (US) 2010-11-25 WO disclosed
WO-2010135530-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR MODULATING URIC ACID LEVELS ARDEA BIOSCIENCES, INC. (US) 2010-11-25 WO disclosed