SCHEMBL4440599

SCHEMBL4440599

[c]1cc(Oc2ccccc2)[c]cc1Oc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 7/20 0.55
TSHR P16473 1/20 0.55
NR1H2 P55055 1/20 0.42
BAX Q07812 1/20 0.42
MAOA P21397 1/20 0.42
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GLA P06280 1/20 0.41
MAPT P10636 1/20 0.41
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
MAOB P27338 1/20 0.38
CA4 P22748 1/20 0.38
GSTP1 P09211 1/20 0.35
SOS1 Q07889 1/20 0.35
CA9 Q16790 1/20 0.35
PARP10 Q53GL7 1/20 0.35
PLA2G2A P14555 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL3051760 0.81 LTA4H (0.52) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL134369 0.80 LTA4H (0.44) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL27493935 0.80 LTA4H (0.44) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL28994484 0.78 LTA4H (0.42) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL359816 0.78 LTA4H (0.42) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL3334894 0.77 SRD5A2 (0.43) LTA4HTSHRNR1H2BAXKMT2A
SCHEMBL76698 0.75 LTA4H (0.50) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL1451346 0.74 LTA4H (0.55) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL17273646 0.74 LTA4H (0.73) LTA4HTSHRNR1H2BAXMAOA
Diphenylether SCHEMBL9061108 0.73 LTA4H (1.00) LTA4HTSHRNR1H2BAXMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2473469-A2 PROCESS FOR THE SYNTHESIS OF FLUORINATED ETHERS OF AROMATIC ACIDS E. I. du Pont de Nemours and Company (US) 2012-07-11 EP disclosed
EP-2473470-A2 PROCESS FOR THE SYNTHESIS OF FLUORINATED ETHERS OF AROMATIC ACIDS E. I. du Pont de Nemours and Company (US) 2012-07-11 EP disclosed
EP-2473472-A2 PROCESS FOR THE SYNTHESIS OF FLUORINATED ETHERS OF AROMATIC ACIDS E. I. du Pont de Nemours and Company (US) 2012-07-11 EP disclosed
EP-2473468-A2 PROCESS FOR THE SYNTHESIS OF FLUORINATED ETHERS OF AROMATIC ACIDS E. I. du Pont de Nemours and Company (US) 2012-07-11 EP disclosed
EP-2473471-A2 PROCESS FOR THE SYNTHESIS OF FLUORINATED ETHERS OF AROMATIC ACIDS E. I. du Pont de Nemours and Company (US) 2012-07-11 EP disclosed
EP-2125688-A1 PROCESS FOR THE SYNTHESIS OF ETHERS OF AROMATIC ACIDS E. I. Du Pont de Nemours and Company (US) 2009-12-02 EP disclosed
WO-2008082510-A1 PROCESS FOR THE SYNTHESIS OF ETHERS OF AROMATIC ACIDS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2008-07-10 WO disclosed