SCHEMBL974486

SCHEMBL974486

Cc1ccc(C)n1-c1ccccc1C(=O)NO

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MYC P01106 13/20 0.67
NR4A1 P22736 3/20 0.66
KDM4E B2RXH2 3/20 0.48
GAA P10253 3/20 0.48
MPO P05164 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HIF1A Q16665 1/20 0.48
MMP3 P08254 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
MEN1 O00255 2/20 0.44
USP2 O75604 2/20 0.44
KMT2A Q03164 2/20 0.44
TP53 P04637 1/20 0.44
HTT P42858 1/20 0.44
MAPT P10636 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
PTPN1 P18031 1/20 0.44
LMNA P02545 1/20 0.43

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
SCHEMBL17172418 0.80 MYC (1.00) MYCNR4A1
SCHEMBL13856248 0.79 MYC (1.00) MYCNR4A1ALDH1A1PTPN1
SCHEMBL15714477 0.79 MYC (1.00) MYCNR4A1KDM4ESMN1; SMN2MEN1
SCHEMBL17172437 0.78 MYC (0.70) MYCNR4A1KDM4EGAAMEN1
SCHEMBL15714912 0.78 MYC (0.74) MYCNR4A1KDM4EMEN1KMT2A
SCHEMBL974278 0.74 ALDH1A1 (0.71) KDM4EGAAMPOSMN1; SMN2HIF1A
SCHEMBL1331243 0.73 GAA (0.73) KDM4EGAAMPOSMN1; SMN2HIF1A
SCHEMBL4815209 0.72 HPGD (0.62) KDM4EGAAMPOSMN1; SMN2HIF1A
SCHEMBL8773443 0.72 HPGD (0.62) KDM4EGAAMPOSMN1; SMN2HIF1A
SCHEMBL17172445 0.72 MYC (0.71) MYCNR4A1KDM4EGAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8673911-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2014-03-18 US disclosed
US-8673911-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2014-03-18 US disclosed
US-8673911-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2014-03-18 US disclosed
US-20140045850-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2014-02-13 US disclosed
US-20140045850-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2014-02-13 US disclosed
US-20140045850-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2014-02-13 US disclosed
US-20110021771-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2011-01-27 US disclosed
US-20110021771-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2011-01-27 US disclosed
US-20110021771-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2011-01-27 US disclosed
EP-2217588-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2010-08-18 EP disclosed
WO-2009055917-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2009-05-07 WO disclosed
WO-2009055917-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2009-05-07 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-20110021771-A1 INHIBITORS OF HISTONE DEACETYLASE HDAC1, HDAC11, HDAC3 MYC 3552/4885NR4A1 90/4885KDM4E 165/4885
US-20140045850-A1 INHIBITORS OF HISTONE DEACETYLASE HDAC1, HDAC11, HDAC3 MYC 3552/4885NR4A1 90/4885KDM4E 165/4885

“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.