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SCHEMBL10693565

SCHEMBL10693565

O=C1C=CC(=O)N1c1cccc(Oc2ccc(CCCc3ccc(Oc4cccc(N5C(=O)C=CC5=O)c4)cc3)cc2)c1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 14/20 0.55
▸ FAAH O00519 6/20 0.51
▸ HSP90AA1 P07900 3/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ HPN P05981 1/20 0.41
▸ NR1H3 Q13133 1/20 0.40
▸ FFAR1 O14842 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
SCHEMBL486508 0.94 MGLL (0.58) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL29391803 0.94 MGLL (0.58) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL27856088 0.92 MGLL (0.56) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL27846512 0.89 MGLL (0.60) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL486546 0.88 MGLL (0.58) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL29389066 0.88 MGLL (0.58) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL29391228 0.87 MGLL (0.70) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL9491223 0.87 MGLL (0.70) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL29754402 0.87 MGLL (0.70) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL487151 0.87 MGLL (0.70) MGLLFAAHHSP90AA1ALDH1A1PKM

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-0253586-A1 Thermosetting resin composition MITSUI TOATSU CHEMICALS, Inc. (JP) 1988-01-20 — — EP disclosed