SCHEMBL4431099

SCHEMBL4431099

COC(=O)/C=C/c1ccc(OCCCCCCCI)c(OC)c1

nearest known ligand 0.79

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FDPS P14324 3/20 0.79
ACHE P22303 12/20 0.60
BCHE P06276 7/20 0.60
APP P05067 2/20 0.58
KDM4E B2RXH2 1/20 0.57
EPHX2 P34913 1/20 0.56
NFE2L2 Q16236 1/20 0.56

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
SCHEMBL13168876 0.90 FDPS (0.92) FDPSACHEBCHEAPPKDM4E
SCHEMBL6026533 0.89 KDM4E (0.73) FDPSACHEBCHEAPPKDM4E
SCHEMBL6026535 0.89 KDM4E (0.73) FDPSACHEBCHEAPPKDM4E
SCHEMBL4421209 0.89 FDPS (0.81) FDPSACHEBCHEAPPKDM4E
SCHEMBL6873903 0.89 FDPS (0.81) FDPSACHEBCHEAPPKDM4E
SCHEMBL6873896 0.89 FDPS (0.81) FDPSACHEBCHEAPPKDM4E
SCHEMBL29120403 0.88 FDPS (0.79) FDPSACHEBCHEAPPKDM4E
SCHEMBL29120399 0.88 FDPS (0.79) FDPSACHEBCHEAPPKDM4E
SCHEMBL29120421 0.88 FDPS (0.79) FDPSACHEBCHEAPPKDM4E
SCHEMBL29120410 0.88 FDPS (0.79) FDPSACHEBCHEAPPKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7491752-B2 Photoactive materials ROLIC AG (CH) 2009-02-17 US disclosed
US-20040265742-A1 Photoactive materials ROLIC AG (CH) 2004-12-30 US disclosed