SCHEMBL2019170

SCHEMBL2019170

CC(=O)Nc1ccc(N)c(C)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
LMNA P02545 1/20 0.46
SCN9A Q15858 1/20 0.44
SCN2A Q99250 1/20 0.44
SCN3A Q9NY46 1/20 0.44
SCN10A Q9Y5Y9 1/20 0.44
PTK2 Q05397 1/20 0.43
GRM5 P41594 1/20 0.43
CYP1A2 P05177 1/20 0.42
GAA P10253 1/20 0.42
MAPK8 P45983 6/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
ADORA3 P0DMS8 2/20 0.41
MAPK9 P45984 3/20 0.40
PRKD3 O94806 2/20 0.40
MAP4K4 O95819 2/20 0.40
MAP4K2 Q12851 2/20 0.40
MAP4K5 Q9Y4K4 2/20 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
SCHEMBL10397830 0.83 SCN9A (0.52) KDM4ELMNASCN9ASCN2ASCN3A
SCHEMBL9753194 0.81 SORT1 (0.53) KDM4ELMNAPTK2CYP1A2GAA
SCHEMBL13922789 0.80 GRM5 (0.42) KDM4ELMNAGRM5CYP1A2L3MBTL1
SCHEMBL9974219 0.78 KDM4E (0.46) KDM4ELMNASCN9ASCN2ASCN3A
SCHEMBL28545686 0.78 PTK2 (0.51) KDM4ELMNASCN9ASCN2ASCN3A
SCHEMBL1269767 0.78 RAB9A (0.60) KDM4ELMNACYP1A2L3MBTL1NPC1
SCHEMBL7092192 0.78 SMN1; SMN2 (0.48) KDM4ELMNAPTK2CYP1A2GAA
SCHEMBL19736135 0.78 GRM5 (0.50) KDM4ELMNASCN9ASCN2ASCN3A
SCHEMBL24819762 0.77 LCK (0.41) SCN9AGRM5MAP4K4HDAC1
SCHEMBL30050964 0.77 LCK (0.41) SCN9AGRM5MAP4K4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9175003-B2 Substituted azoanthracene derivatives and intermediates for preparation thereof VTV THERAPEUTICS LLC (US) 2015-11-03 US disclosed
EP-2413693-B1 SUBSTITUTED AZOANTHRACENE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF VTV THERAPEUTICS LLC (US) 2015-09-09 EP disclosed
US-20150148539-A1 Substituted Azoanthracene Derivatives and Intermediates for Preparation Thereof VTV THERAPEUTICS LLC 2015-05-28 US disclosed
US-8987295-B2 Substituted azoanthracene derivatives, pharmaceutical compositions, and methods of use thereof TRANSTECH PHARMA, LLC (US) 2015-03-24 US disclosed
CN-102378574-B Substituted azoanthracene derivatives, pharmaceutical compositions, and methods of use thereof TRANSTECH PHARMA INC 2013-11-20 CN disclosed
US-20130096150-A1 Substituted Azoanthracene Derivatives, Pharmaceutical Compositions, and Methods of Use Thereof TRANSTECH PHARMA, INC. (US) 2013-04-18 US disclosed
US-8383644-B2 Substituted azoanthracene derivatives, pharmaceutical compositions, and methods of use thereof TRANSTECH PHARMA, INC. (US) 2013-02-26 US disclosed
CN-102378574-A Substituted azoanthracene derivatives, pharmaceutical compositions, and methods of use thereof TRANSTECH PHARMA INC 2012-03-14 CN disclosed
US-20110160198-A1 SUBSTITUTED AZOANTHRACENE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF HIGH POINT PHARMACEUTICALS, LLC (US) 2011-06-30 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 (3 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-20130096150-A1 Substituted Azoanthracene Derivatives, Pharmaceutical Compositions, and Methods of Use Thereof GLP1R, GIPR, GPR119 KDM4E 1477/4885LMNA 3163/4885SCN9A 2222/4885
US-20110160198-A1 SUBSTITUTED AZOANTHRACENE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF GLP1R, GIPR, GPR119 KDM4E 1477/4885LMNA 3163/4885SCN9A 2222/4885
US-20150148539-A1 Substituted Azoanthracene Derivatives and Intermediates for Preparation Thereof GLP1R, GIPR, GPR119 KDM4E 1742/4885LMNA 1306/4885SCN9A 2913/4885

“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.