SCHEMBL28674166

SCHEMBL28674166

O=C(O)c1cc2oc3ccccc3c2cc1C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBK1 Q9UHD2 1/20 0.60
KDM4E B2RXH2 4/20 0.55
HPGD P15428 3/20 0.55
GLA P06280 2/20 0.55
ALDH1A1 P00352 2/20 0.55
GAA P10253 1/20 0.55
TTR P02766 2/20 0.54
AHR P35869 2/20 0.52
GPR35 Q9HC97 2/20 0.50
USP2 O75604 1/20 0.50
CSNK2A2 P19784 1/20 0.50
PTGS1 P23219 1/20 0.50
CSNK2B P67870 1/20 0.50
CSNK2A1 P68400 1/20 0.50
CSNK2A3 Q8NEV1 1/20 0.50
LMNA P02545 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
MAPT P10636 2/20 0.47
TSHR P16473 2/20 0.47

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
SCHEMBL28816389 0.88 TBK1 (0.56) TBK1KDM4EHPGDGLAALDH1A1
SCHEMBL2761273 0.88 TBK1 (0.52) TBK1KDM4EHPGDGLAALDH1A1
SCHEMBL26674858 0.86 TBK1 (0.81) TBK1KDM4EHPGDGLAALDH1A1
SCHEMBL23260298 0.84 TBK1 (0.49) TBK1KDM4EHPGDGLAALDH1A1
SCHEMBL8964810 0.82 ALDH1A1 (0.60) KDM4EHPGDALDH1A1GAAAHR
Dibenzofuran SCHEMBL9651343 0.80 KDM4E (0.61) KDM4EHPGDGLAALDH1A1TTR
Dibenzofuran SCHEMBL7810840 0.80 KDM4E (0.61) KDM4EHPGDGLAALDH1A1TTR
SCHEMBL20793652 0.79 GPR35 (0.51) TBK1KDM4EHPGDGLAALDH1A1
SCHEMBL16714053 0.78 TTR (0.84) TBK1KDM4EHPGDALDH1A1GAA
SCHEMBL1222307 0.78 TTR (0.78) KDM4EHPGDGLAALDH1A1TTR

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
CN-108239054-B Preparation method of benzofuran-3-carboxylic acid 上海奥博生物医药股份有限公司 2022-01-21 CN disclosed