SCHEMBL4394481

SCHEMBL4394481

CCc1oc2cccc(-c3cc(Br)c(O)c(Br)c3)c2c1C=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 8/20 0.46
SLC22A12 Q96S37 7/20 0.46
CYP2C19 P33261 5/20 0.46
EYA3 Q99504 4/20 0.46
CYP2C9 P11712 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
PTPN1 P18031 2/20 0.46
ABCB11 O95342 2/20 0.46
LMNA P02545 2/20 0.46
PGR P06401 2/20 0.46
ADRA2A P08913 2/20 0.46
TBXA2R P21731 2/20 0.46
OPRM1 P35372 2/20 0.46
SLC6A3 Q01959 2/20 0.46
EYA2 O00167 1/20 0.46
ABCC4 O15439 1/20 0.46
PLIN1 O60240 1/20 0.46
NR1I2 O75469 1/20 0.46
USP2 O75604 1/20 0.46

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
SCHEMBL2849716 0.81 TTR (0.60) TTRSLC22A12CYP2C19EYA3CYP2C9
SCHEMBL5483047 0.70 MEN1 (0.41) TTRSLC22A12CYP2C19EYA3CYP2C9
SCHEMBL5063026 0.69 SLC22A12 (0.39) TTRSLC22A12CYP2C19EYA3CYP2C9
SCHEMBL28104532 0.69 CYP2C19 (0.62) TTRSLC22A12CYP2C19EYA3CYP2C9
SCHEMBL30258603 0.67 TTR (0.76) TTRSLC22A12CYP2C19EYA3CYP2C9
SCHEMBL6336631 0.67 TTR (0.78) TTRSLC22A12CYP2C19EYA3CYP2C9
SCHEMBL30258692 0.66 TTR (0.68) TTRSLC22A12CYP2C19EYA3CYP2C9
SCHEMBL719026 0.65 EYA3 (0.48) TTRSLC22A12CYP2C19EYA3CYP2C9
SCHEMBL28078332 0.65 SLC22A12 (0.58) TTRSLC22A12EYA3CYP2C9KMT2A
Benzbromarone SCHEMBL19205474 0.63 SLC22A12 (1.00) TTRSLC22A12CYP2C19EYA3CYP2C9

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-7498301-B2 Composition containing dipeptide of histidine and alanine for reducing uric acid and method for reducing uric acid using the dipeptide LYTONE ENTERPRISE, INC. (TW) 2009-03-03 US claimed