SCHEMBL21409967

SCHEMBL21409967

CC1=CC(=O)N(c2cccc(N3C(=O)C=CC3=O)c2)C1=O

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 12/20 0.66
FAAH O00519 5/20 0.66
HSP90AA1 P07900 4/20 0.61
ALDH1A1 P00352 1/20 0.50
PKM P14618 1/20 0.50
HTT P42858 1/20 0.50
ATM Q13315 1/20 0.50
HPN P05981 1/20 0.46
CCR6 P51684 2/20 0.44
G6PD P11413 1/20 0.39
TLR9 Q9NR96 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL96043 0.93 MGLL (0.52) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL20385941 0.89 CCR6 (0.55) MGLLFAAHHSP90AA1CCR6G6PD
SCHEMBL4839640 0.85 MGLL (0.61) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL9508528 0.83 MGLL (0.58) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL24208255 0.82 MGLL (0.46) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL26659447 0.81 MEN1 (0.47) MGLLFAAHHSP90AA1ALDH1A1L3MBTL1
SCHEMBL1838889 0.81 MGLL (1.00) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL94730 0.81 MGLL (1.00) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL21756621 0.80 MGLL (0.46) MGLLFAAHHSP90AA1ALDH1A1HTT
SCHEMBL774452 0.80 MGLL (0.50) MGLLFAAHALDH1A1PKMTLR9

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
WO-2019189458-A1 LATENT CURING CATALYST FOR EPOXY RESIN AND EPOXY RESIN COMPOSITION USING SAME ナガセケムテックス株式会社 2019-10-03 WO disclosed