SCHEMBL2319124

SCHEMBL2319124

NN=Cc1ccc(O)c(O)c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 7/20 0.56
EIF4H Q15056 1/20 0.56
AMY1A P0DUB6 1/20 0.52
KDM4E B2RXH2 6/20 0.51
GAA P10253 6/20 0.51
MAPT P10636 6/20 0.51
ALDH1A1 P00352 4/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
APEX1 P27695 3/20 0.51
TDP1 Q9NUW8 3/20 0.51
MPI P34949 2/20 0.51
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
CASP6 P55212 1/20 0.50
MCL1 Q07820 4/20 0.49
BLM P54132 3/20 0.49
G6PD P11413 2/20 0.49
HPGD P15428 2/20 0.49
NSD2 O96028 1/20 0.49
LMNA P02545 1/20 0.49

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
SCHEMBL28420537 1.00 POLB (0.56) POLBEIF4HAMY1AKDM4EGAA
SCHEMBL2316674 0.80 POLB (0.69) POLBKDM4EGAAMAPTALDH1A1
SCHEMBL6073351 0.79 POLB (0.53) POLBEIF4HAMY1AKDM4EGAA
SCHEMBL6073350 0.79 POLB (0.53) POLBEIF4HAMY1AKDM4EGAA
SCHEMBL11111555 0.72 MAOB (0.38) POLBEIF4HGAAMAPTL3MBTL1
SCHEMBL2649889 0.72 IDO1 (0.52) MEN1KMT2A
SCHEMBL11111572 0.72 MAOB (0.38) POLBEIF4HGAAMAPTL3MBTL1
SCHEMBL11410155 0.72 MAOB (0.59) POLBEIF4HAMY1AKDM4EGAA
SCHEMBL6073220 0.72 SRC (0.52) POLBEIF4HAMY1AKDM4EGAA
SCHEMBL11410159 0.72 MAOB (0.59) POLBEIF4HAMY1AKDM4EGAA

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-9296716-B2 Androgen receptor ligands THE PROVOST, FELLOWS, FOUNDATION SCHOLARS, & THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY AND UNDIV. TRINITY OF QUEEN ELIZABETH NEAR DUBLIN (IE) 2016-03-29 US claimed
US-20140357682-A1 ANDROGEN RECEPTOR LIGANDS The Provost, Fellows, Foundation Scholars, & the Other Members of Board, of The College of the Holy (IE) 2014-12-04 US claimed
US-9296716-B2 Androgen receptor ligands THE PROVOST, FELLOWS, FOUNDATION SCHOLARS, & THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY AND UNDIV. TRINITY OF QUEEN ELIZABETH NEAR DUBLIN (IE) 2016-03-29 US disclosed
US-20140357682-A1 ANDROGEN RECEPTOR LIGANDS The Provost, Fellows, Foundation Scholars, & the Other Members of Board, of The College of the Holy (IE) 2014-12-04 US disclosed
EP-2782643-A1 ANDROGEN RECEPTOR LIGANDS The Provost, Fellows, Foundation Scholars, & the other members of Board, of the College of the Holy & Undiv. Trinity of Queen Elizabeth near Dublin (IE) 2014-10-01 EP disclosed
WO-2013076275-A1 ANDROGEN RECEPTOR LIGANDS THE PROVOST, FELLOWS, FOUNDATION SCHOLARS, & THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY & UNDIV.TRINITY OF QUEEN ELIZABETH NEAR DUBLIN (IE) 2013-05-30 WO disclosed
US-20110189306-A1 COMPOUNDS, COMPOSITIONS AND TREATMENTS FOR V-ATPase RELATED DISEASES KARTNER NORBERT 2011-08-04 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 (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-20140357682-A1 ANDROGEN RECEPTOR LIGANDS AR, NR5A1, SHBG POLB 2829/4885EIF4H 1779/4885AMY1A 4418/4885
US-20110189306-A1 COMPOUNDS, COMPOSITIONS AND TREATMENTS FOR V-ATPase RELATED DISEASES ATP6V1E1, ATP6V1G1, ATP6V1H POLB 1569/4885EIF4H 3495/4885AMY1A 1214/4885

“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.