SCHEMBL20181390

SCHEMBL20181390

CCc1nc2ccc(Br)cn2c1C(=O)c1cc(Br)c(O)c(Br)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 11/20 0.39
EYA3 Q99504 3/20 0.39
TTR P02766 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPK1 P28482 2/20 0.39
CYP2C9 P11712 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPT P10636 2/20 0.39
EYA2 O00167 1/20 0.39
ABCC4 O15439 1/20 0.39
PLIN1 O60240 1/20 0.39
NR1I2 O75469 1/20 0.39
USP2 O75604 1/20 0.39
ABCB11 O95342 1/20 0.39
LMNA P02545 1/20 0.39
ALB P02768 1/20 0.39
ESR1 P03372 1/20 0.39
NR3C1 P04150 1/20 0.39
CYP1A2 P05177 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
SCHEMBL18629847 0.90 SLC22A12 (0.43) SLC22A12EYA3TTRALDH1A1MAPK1
SCHEMBL18629835 0.89 RAB9A (0.44) SLC22A12EYA3TTRALDH1A1MAPK1
SCHEMBL18629846 0.86 SLC22A12 (0.47) SLC22A12EYA3TTRALDH1A1MAPK1
SCHEMBL18629885 0.85 SLC22A12 (0.38) SLC22A12EYA3TTRALDH1A1MAPK1
SCHEMBL18629888 0.85 SLC22A12 (0.37) SLC22A12EYA3TTRALDH1A1MAPK1
SCHEMBL18629839 0.84 MAPK1 (0.46) SLC22A12EYA3TTRALDH1A1MAPK1
SCHEMBL21176882 0.83 SLC22A12 (0.37) SLC22A12EYA3TTRALDH1A1MAPK1
SCHEMBL18629791 0.83 CYP3A4 (0.39) SLC22A12EYA3TTRALDH1A1MAPK1
SCHEMBL18629881 0.81 CYP2C9 (0.42) SLC22A12EYA3TTRALDH1A1MAPK1
SCHEMBL20181391 0.81 LMNA (0.49) SLC22A12ALDH1A1MAPK1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3543240-B1 URAT1 INHIBITOR AND USE THEREOF JIANGSU ATOM BIOSCIENCE AND PHARMACEUTICAL CO LTD (CN) 2022-07-06 EP disclosed
EP-3543240-A1 URAT1 INHIBITOR AND USE THEREOF Jiangsu Atom Bioscience And Pharmaceutical Co., Ltd. (CN) 2019-09-25 EP disclosed
WO-2018090921-A1 URAT1 INHIBITOR AND USE THEREOF 江苏新元素医药科技有限公司 2018-05-24 WO disclosed