SCHEMBL8770494

SCHEMBL8770494

O=C1OCC(c2cccc(Cl)c2)=C1c1ccccc1OCc1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 13/20 0.60
MAOA P21397 2/20 0.46
MAOB P27338 2/20 0.46
CYP2C9 P11712 2/20 0.45
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL8770509 0.92 PTGER1 (0.58) PTGER1MAOAMAOBCYP2C9KDM4E
SCHEMBL8770553 0.91 PTGER1 (0.53) PTGER1MAOAMAOBCYP2C9KDM4E
SCHEMBL8770492 0.87 PTGER1 (0.58) PTGER1MAOAMAOBCYP2C9
SCHEMBL8770407 0.86 PTGER1 (0.49) PTGER1MAOAMAOBKDM4EALDH1A1
SCHEMBL8770489 0.83 PTGER1 (0.47) PTGER1MAOAMAOB
SCHEMBL8770371 0.81 PTGER1 (0.47) PTGER1POLB
SCHEMBL4882977 0.81 PTGER1 (0.87) PTGER1CYP2C9
SCHEMBL8770545 0.79 PTGER1 (0.50) PTGER1MAOAMAOB
SCHEMBL8770706 0.79 PTGER1 (0.44) PTGER1MAOAMAOB
SCHEMBL8770486 0.78 PTGER1 (0.46) PTGER1MAOAMAOBLMNA

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-0566175-B1 3,4-Diaryl (5H)-furan-2-one based compounds with fungicide activity MINI RICERCA SCIENT TECNOLOG (IT) 1997-08-06 EP disclosed
US-5371106-A Reacting arylacetic acid derivative with haloketone derivative in a solvent in presence of stoichiometric amount of base to form phenacyl ester derivative which is cyclized in situ by adding base MINISTERO DELL'UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECHNOLOGICA (IT) 1994-12-06 US disclosed
EP-0566175-A2 3,4-Diaryl (5H)-furan-2-one based compounds with fungicide activity MINISTERO DELL' UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECNOLOGICA (IT) 1993-10-20 EP disclosed