SCHEMBL10195154

SCHEMBL10195154

COc1ccc(CCN2C(=O)CC(=O)N(CCc3ccc(OC)cc3)C2=O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 2/20 0.64
GSK3B P49841 2/20 0.64
MEN1 O00255 5/20 0.63
KMT2A Q03164 5/20 0.63
MAPT P10636 3/20 0.63
L3MBTL1 Q9Y468 2/20 0.63
GAA P10253 2/20 0.63
HTT P42858 2/20 0.63
USP2 O75604 1/20 0.63
HSD17B10 Q99714 1/20 0.63
ALDH1A1 P00352 5/20 0.61
TSHR P16473 1/20 0.61
CMA1 P23946 1/20 0.57
SIGMAR1 Q99720 1/20 0.56
HRH3 Q9Y5N1 1/20 0.53
POLB P06746 1/20 0.51
BLM P54132 1/20 0.49
APAF1 O14727 1/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48

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
SCHEMBL10159069 0.94 ALDH1A1 (0.60) GSK3AGSK3BMEN1KMT2AMAPT
SCHEMBL10159063 0.94 MAPT (0.74) GSK3AGSK3BMEN1KMT2AMAPT
SCHEMBL8117134 0.83 CMA1 (0.77) GSK3AGSK3BMEN1KMT2AMAPT
SCHEMBL28967239 0.81 GSK3A (0.64) GSK3AGSK3BMEN1KMT2AMAPT
SCHEMBL10195155 0.80 HSP90AA1 (0.67) MEN1KMT2AMAPTL3MBTL1GAA
SCHEMBL12615721 0.78 GSK3A (0.60) GSK3AGSK3BMEN1KMT2AMAPT
SCHEMBL3381344 0.78 GSK3A (1.00) GSK3AGSK3BMEN1KMT2AALDH1A1
SCHEMBL10159099 0.78 MAPT (0.69) MEN1KMT2AMAPTL3MBTL1GAA
SCHEMBL10159071 0.78 MAPT (0.69) MEN1KMT2AMAPTL3MBTL1GAA
SCHEMBL3419741 0.78 CMA1 (0.57) GSK3AGSK3BMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3144299-A1 PYRIMIDINE-2,4,6-TRIONES FOR USE IN THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS Cambria Pharmaceuticals, Inc. (US) 2017-03-22 EP disclosed
US-9499494-B2 Pyrimidine-2,4,6-triones for use in the treatment of amyotrophic lateral sclerosis NORTHWESTERN UNIVERSITY (US) 2016-11-22 US disclosed
EP-2427438-B1 PYRIMIDINE-2,4,6-TRIONES FOR USE IN THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS CAMBRIA PHARMACEUTICALS INC (US) 2016-10-12 EP disclosed
US-20150203456-A1 PYRIMIDINE-2,4,6-TRIONES FOR USE IN THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS CAMBRIA PHARMACEUTICALS DISTRIBUTING TRUST 2015-07-23 US disclosed
US-20120046309-A1 PYRIMIDINE-2,4,6-TRIONES FOR USE IN THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS NORTHWESTERN UNIVERSITY (US) 2012-02-23 US disclosed
WO-2010129665-A2 PYRIMIDINE-2,4,6-TRIONES FOR USE IN THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS CAMBRIA PHARMACEUTICALS, INC. (US) 2010-11-11 WO 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 (2 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-20150203456-A1 PYRIMIDINE-2,4,6-TRIONES FOR USE IN THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS NUDT1, TYMP, HPRT1 GSK3A 1716/4885GSK3B 1347/4885MEN1 4617/4885
US-20120046309-A1 PYRIMIDINE-2,4,6-TRIONES FOR USE IN THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS NUDT1, TYMP, HPRT1 GSK3A 1716/4885GSK3B 1347/4885MEN1 4617/4885

“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.