SCHEMBL11891753

SCHEMBL11891753

CCOc1ccccc1C(=O)Nc1ccccc1OC=O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.69
GAA P10253 2/20 0.69
MAPK1 P28482 2/20 0.69
L3MBTL1 Q9Y468 2/20 0.64
ALDH1A1 P00352 1/20 0.64
RXFP1 Q9HBX9 4/20 0.60
HSD17B10 Q99714 2/20 0.60
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
KCNMA1 Q12791 2/20 0.58
TSHR P16473 2/20 0.57
TP53 P04637 2/20 0.57
LMNA P02545 2/20 0.57
KDM4E B2RXH2 1/20 0.57
HPGD P15428 1/20 0.57
ATM Q13315 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
HCRTR1 O43613 1/20 0.57
USP2 O75604 1/20 0.57
ALOX15 P16050 1/20 0.57

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
SCHEMBL15323115 0.87 GAA (0.78) MAPTGAAMAPK1L3MBTL1ALDH1A1
SCHEMBL4433924 0.82 MAPT (0.74) MAPTGAAMAPK1L3MBTL1ALDH1A1
SCHEMBL328592 0.82 GAA (0.74) MAPTGAAMAPK1L3MBTL1ALDH1A1
SCHEMBL15528654 0.81 MAPT (0.74) MAPTGAAMAPK1L3MBTL1ALDH1A1
SCHEMBL11600983 0.79 MAPT (0.70) MAPTGAAMAPK1L3MBTL1ALDH1A1
SCHEMBL7820773 0.79 KMT2A (0.71) MAPTGAAMAPK1L3MBTL1ALDH1A1
SCHEMBL5312632 0.79 GAA (0.79) MAPTGAAMAPK1L3MBTL1ALDH1A1
SCHEMBL14305179 0.78 HSD17B10 (0.70) MAPTGAAMAPK1L3MBTL1ALDH1A1
SCHEMBL26804179 0.77 GAA (0.54) MAPTGAAMAPK1L3MBTL1ALDH1A1
SCHEMBL5504642 0.77 MEN1 (0.83) MAPTGAAMAPK1L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9320734-B2 Small molecule inhibitors of the pleckstrin homology domain and methods for using same BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2016-04-26 US disclosed
US-20150126563-A1 SMALL MOLECULE INHIBITORS OF THE PLECKSTRIN HOMOLOGY DOMAIN AND METHODS FOR USING SAME BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2015-05-07 US disclosed
US-8962663-B2 Small molecule inhibitors of the pleckstrin homology domain and methods for using same BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2015-02-24 US disclosed
US-20130184317-A1 SMALL MOLECULE INHIBITORS OF THE PLECKSTRIN HOMOLOGY DOMAIN AND METHODS FOR USING SAME ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2013-07-18 US disclosed
US-8420678-B2 Small molecule inhibitors of the pleckstrin homology domain and methods for using same BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-04-16 US disclosed
US-20120189670-A1 PHARMACEUTICAL COMPOSITIONS AND FORMULATIONS INCLUDING INHIBITORS OF THE PLECKSTRIN HOMOLOGY DOMAIN AND METHODS FOR USING SAME PHUSIS THERAPEUTICS INC. 2012-07-26 US disclosed
US-20110144066-A1 SMALL MOLECULE INHIBITORS OF THE PLECKSTRIN HOMOLOGY DOMAIN AND METHODS FOR USING SAME THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2011-06-16 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 (4 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-20110144066-A1 SMALL MOLECULE INHIBITORS OF THE PLECKSTRIN HOMOLOGY DOMAIN AND METHODS FOR USING SAME PLEKHG3, PLEKHA1, PLEC MAPT 1329/4885GAA 3079/4885MAPK1 1416/4885
US-20150126563-A1 SMALL MOLECULE INHIBITORS OF THE PLECKSTRIN HOMOLOGY DOMAIN AND METHODS FOR USING SAME PLEKHG3, PLEKHA1, PLEC MAPT 1329/4885GAA 3079/4885MAPK1 1416/4885
US-20130184317-A1 SMALL MOLECULE INHIBITORS OF THE PLECKSTRIN HOMOLOGY DOMAIN AND METHODS FOR USING SAME PLEKHG3, PLEKHA1, PLEC MAPT 1329/4885GAA 3079/4885MAPK1 1416/4885
US-20120189670-A1 PHARMACEUTICAL COMPOSITIONS AND FORMULATIONS INCLUDING INHIBITORS OF THE PLECKSTRIN HOMOLOGY DOMAIN AND METHODS FOR USING SAME PLEKHG3, PLEC, PLEKHA1 MAPT 559/4885GAA 1713/4885MAPK1 2212/4885

“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.