SCHEMBL9848795

SCHEMBL9848795

COC(OCc1cccc(Oc2ccccc2)c1)C(C)(C)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 3/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
FFAR1 O14842 4/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CETP P11597 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
FAAH O00519 1/20 0.39
PTGES O14684 1/20 0.38
MMP1 P03956 1/20 0.38

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
SCHEMBL9848766 0.88 FFAR1 (0.47) KDM4EALDH1A1HTTSMN1; SMN2FFAR1
SCHEMBL9848769 0.87 FFAR1 (0.39) KDM4EALDH1A1HTTSMN1; SMN2FFAR1
SCHEMBL9848787 0.84 CETP (0.48) KDM4EALDH1A1HTTSMN1; SMN2FFAR1
SCHEMBL9339511 0.83 FFAR1 (0.46) KDM4EALDH1A1HTTSMN1; SMN2FFAR1
SCHEMBL9403958 0.79 KDM4E (0.36) KDM4EALDH1A1HTTSMN1; SMN2FFAR1
SCHEMBL9848779 0.76 FFAR1 (0.41) FFAR1CETPTDP1FFAR4PTGES
SCHEMBL9340177 0.74 PKM (0.45) FFAR1CETPFFAR4MMP1
SCHEMBL10532258 0.73 NPC1 (0.44) KDM4EALDH1A1HTTSMN1; SMN2FFAR1
SCHEMBL9858667 0.73 PPARG (0.40) FFAR1CETPFFAR4PTGESMMP1
SCHEMBL9848777 0.73 FFAR1 (0.48) KDM4EALDH1A1HTTSMN1; SMN2FFAR1

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
EP-0421385-A1 Process for producing p-hydroxyneophyl m-phenoxybenzyl ether MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-04-10 EP disclosed