SCHEMBL917030

SCHEMBL917030

Cc1ccc(S(=O)(=O)ON=C(N)NN=Cc2ccc(O)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
KMT2A Q03164 5/20 0.47
RRM1 P23921 1/20 0.46
RRM2 P31350 1/20 0.46
RRM2B Q7LG56 1/20 0.46
MIF P14174 3/20 0.46
FAAH O00519 1/20 0.46
MGLL Q99685 1/20 0.46
ALDH1A1 P00352 7/20 0.45
CYP1A2 P05177 1/20 0.45
LMNA P02545 4/20 0.45
HTT P42858 3/20 0.45
MAPT P10636 4/20 0.44
MEN1 O00255 3/20 0.44
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
GAA P10253 1/20 0.42

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
SCHEMBL915681 0.89 ALDH1A1 (0.55) CA1CA2CA9KMT2AFAAH
SCHEMBL915399 0.89 CA1 (0.48) CA1CA2CA9KMT2AALDH1A1
SCHEMBL916100 0.89 CA1 (0.49) CA1CA2CA9KMT2AFAAH
SCHEMBL915664 0.89 KMT2A (0.50) CA1CA2CA9KMT2AMGLL
SCHEMBL2066512 0.88 KMT2A (0.58) KMT2AFAAHMGLLALDH1A1CYP1A2
SCHEMBL915009 0.87 ALDH1A1 (0.51) KMT2AALDH1A1CYP1A2LMNAHTT
SCHEMBL916837 0.87 KMT2A (0.47) KMT2AALDH1A1CYP1A2LMNAHTT
SCHEMBL916886 0.86 KMT2A (0.58) KMT2AALDH1A1CYP1A2LMNAHTT
SCHEMBL915975 0.86 MAPT (0.53) KMT2AALDH1A1LMNAHTTMAPT
SCHEMBL7199190 0.86 ALDH1A1 (0.49) CA1CA2CA9KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130295009-A1 METHOD OF TREATING INFLAMMATION HPF IP HOLDING S.A. (LU) 2013-11-07 US claimed
US-9227927-B2 Method of treating inflammation ANAMAR AB (SE) 2016-01-05 US disclosed
US-20130295009-A1 METHOD OF TREATING INFLAMMATION HPF IP HOLDING S.A. (LU) 2013-11-07 US disclosed
US-8410174-B2 Method for treating arthritis ANAMAR AB (SE) 2013-04-02 US disclosed
US-8309609-B2 Use of benzylideneaminoguanidines and hydroxyguanidines as melanocortin receptor ligands ANAMAR AB (SE) 2012-11-13 US disclosed
US-20120178820-A1 METHOD FOR TREATING ARTHRITIS ANAMAR AB (SE) 2012-07-12 US disclosed
US-8148429-B2 Use of benzylideneaminoguanidines and hydroxyguanidines as melanocortin receptor ligands ANAMAR AB (SE) 2012-04-03 US disclosed
US-20110015437-A1 USE OF BENZYLIDENEAMINOGUANIDINES AND HYDROXYGUANIDINES AS MELANOCORTIN RECEPTOR LIGANDS ACURE PHARMA AB (SE) 2011-01-20 US disclosed
US-20070231267-A1 Use of benzylideneaminoguanidines and hydroxyguanidines as melanocortin receptor ligands ACURE PHARMA AB (SE) 2007-10-04 US disclosed
US-20070088085-A1 Use of benzylideneaminoguanidines and hydroxyguanidines as melanocortin receptor ligands MELACURE THERAPEUTICS AB (SE) 2007-04-19 US disclosed
US-20040024060-A1 Use of benzylideneaminoguanidines and hydroxyguanidines as melanocortin receptor ligands ACURE PHARMA AB (SE) 2004-02-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070231267-A1 Use of benzylideneaminoguanidines and hydroxyguanidines as melanocortin receptor ligands MC1R, MC5R, MCHR1 CA12 3725/4885CA1 4063/4885CA2 1389/4885
US-20040024060-A1 Use of benzylideneaminoguanidines and hydroxyguanidines as melanocortin receptor ligands MC1R, MC5R, MCHR1 CA12 3673/4885CA1 3987/4885CA2 1316/4885
US-20070088085-A1 Use of benzylideneaminoguanidines and hydroxyguanidines as melanocortin receptor ligands MC1R, MC5R, MCHR1 CA12 3725/4885CA1 4063/4885CA2 1389/4885
US-20110015437-A1 USE OF BENZYLIDENEAMINOGUANIDINES AND HYDROXYGUANIDINES AS MELANOCORTIN RECEPTOR LIGANDS MC1R, MC5R, MCHR1 CA12 3725/4885CA1 4063/4885CA2 1389/4885
US-20130295009-A1 METHOD OF TREATING INFLAMMATION MC2R, MC5R, MC1R CA12 2470/4885CA1 1935/4885CA2 809/4885
US-20120178820-A1 METHOD FOR TREATING ARTHRITIS MC5R, MC1R, MC2R CA12 2130/4885CA1 1652/4885CA2 959/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.