SCHEMBL21152567

SCHEMBL21152567

O=C1C=CC(=O)N1c1cccc(S(=O)(=O)c2cccc(N3C(=O)C=CC3O)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 11/20 0.46
FAAH O00519 5/20 0.46
HSP90AA1 P07900 3/20 0.41
ALDH1A1 P00352 2/20 0.40
PKM P14618 2/20 0.40
HTT P42858 2/20 0.40
ATM Q13315 1/20 0.40
HPN P05981 1/20 0.38
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA7 P43166 2/20 0.36
CA12 O43570 1/20 0.36
CA9 Q16790 1/20 0.36
HTR6 P50406 1/20 0.35
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
XBP1 P17861 1/20 0.34
MAPK1 P28482 1/20 0.34
CCR6 P51684 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL18546007 0.87 MGLL (0.61) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL30408507 0.83 MGLL (0.67) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL9718444 0.83 MGLL (0.67) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL2124055 0.83 MGLL (0.67) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL19840525 0.81 MGLL (0.44) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL23094941 0.75 MGLL (0.56) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL20385939 0.75 NSD2 (0.47) MGLLFAAHHSP90AA1PKMMAPK1
SCHEMBL21377555 0.74 NPC1 (0.46) MGLLFAAHALDH1A1CA2CA12
SCHEMBL19120738 0.72 ALDH1A1 (0.34) MGLLFAAHALDH1A1CA1CA2
SCHEMBL2122028 0.72 MGLL (0.57) 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-3508523-A1 MALEIMIDE RESINS Cytec Industries Inc. (US) 2019-07-10 EP disclosed