SCHEMBL12068656

SCHEMBL12068656

CC(C)COc1cc(C(N)=O)ccc1NC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)c(OCC(C)C)c1

nearest known ligand 0.79

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 3/20 0.79
HIF1A Q16665 1/20 0.79
MYC P01106 7/20 0.73
MAX P61244 6/20 0.73
AR P10275 1/20 0.72
PELP1 Q8IZL8 1/20 0.72
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TOP2A P11388 2/20 0.47
GAA P10253 1/20 0.45
AKR1C3 P42330 1/20 0.45
AKR1C2 P52895 1/20 0.45
AKR1C1 Q04828 1/20 0.45
MAPT P10636 1/20 0.44
ABCB1 P08183 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
SCHEMBL12068664 1.00 EP300 (0.79) EP300HIF1AMYCMAXAR
SCHEMBL12068691 0.99 EP300 (0.81) EP300HIF1AMYCMAXAR
SCHEMBL12068696 0.97 EP300 (0.84) EP300HIF1AMYCMAXAR
SCHEMBL12068651 0.97 EP300 (0.84) EP300HIF1AMYCMAXAR
SCHEMBL12068699 0.96 EP300 (0.82) EP300HIF1AMYCMAXAR
SCHEMBL12070194 0.96 EP300 (0.82) EP300HIF1AMYCMAXAR
SCHEMBL12068655 0.94 EP300 (0.73) EP300HIF1AMYCMAXAR
SCHEMBL12068659 0.92 MYC (0.69) EP300HIF1AMYCMAXAR
SCHEMBL12068700 0.92 MYC (0.69) EP300HIF1AMYCMAXAR
SCHEMBL12068698 0.91 MYC (0.68) EP300HIF1AMYCMAXAR

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
US-9856206-B2 Oligo-benzamide compounds and their use THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2018-01-02 US disclosed
US-20160130217-A1 OLIGO-BENZAMIDE COMPOUNDS AND THEIR USE THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2016-05-12 US disclosed
US-20160130217-A1 OLIGO-BENZAMIDE COMPOUNDS AND THEIR USE THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2016-05-12 US disclosed
US-20130231385-A1 OLIGO-BENZAMIDE COMPOUNDS AND THEIR USE THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEMS (US) 2013-09-05 US disclosed
US-20130231385-A1 OLIGO-BENZAMIDE COMPOUNDS AND THEIR USE THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEMS (US) 2013-09-05 US disclosed
WO-2011150360-A1 OLIGO-BENZAMIDE COMPOUNDS AND THEIR USE THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2011-12-01 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-20160130217-A1 OLIGO-BENZAMIDE COMPOUNDS AND THEIR USE AR, OGFR, BRDT EP300 509/4885HIF1A 1327/4885MYC 23/4885
US-20130231385-A1 OLIGO-BENZAMIDE COMPOUNDS AND THEIR USE AR, OGFR, BRDT EP300 509/4885HIF1A 1327/4885MYC 23/4885

“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.