SCHEMBL2593317

SCHEMBL2593317

O=C(O)c1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1

nearest known ligand 0.97

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.91
KMT2A Q03164 4/20 0.91
ALDH1A1 P00352 3/20 0.91
GLA P06280 3/20 0.91
GAA P10253 3/20 0.91
HPGD P15428 3/20 0.91
MEN1 O00255 3/20 0.86
MAPT P10636 3/20 0.80
CYP1A2 P05177 1/20 0.80
CYP2C19 P33261 1/20 0.80
GFER P55789 1/20 0.80
MAPK14 Q16539 7/20 0.69
MAPK13 O15264 6/20 0.69
MAPK12 P53778 6/20 0.69
MAPK11 Q15759 6/20 0.69
TGFBR1 P36897 2/20 0.69
ALOX5 P09917 1/20 0.69
PTPN1 P18031 1/20 0.69
CSNK1D P48730 1/20 0.65
CSNK1E P49674 1/20 0.65

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
SCHEMBL29103864 0.95 KDM4E (0.83) KDM4EKMT2AALDH1A1GLAGAA
SCHEMBL29642733 0.93 KDM4E (1.00) KDM4EKMT2AALDH1A1GLAGAA
SCHEMBL12561695 0.93 KDM4E (0.80) KDM4EKMT2AALDH1A1GLAGAA
SCHEMBL16497610 0.93 MAPK14 (0.81) KDM4EKMT2AALDH1A1GLAGAA
SCHEMBL12561579 0.91 KDM4E (0.76) KDM4EKMT2AALDH1A1GLAGAA
SCHEMBL12311111 0.90 KDM4E (0.75) KDM4EKMT2AALDH1A1GLAGAA
SCHEMBL28500397 0.89 KDM4E (0.74) KDM4EKMT2AALDH1A1GLAGAA
SCHEMBL5607119 0.88 KDM4E (0.72) KDM4EKMT2AALDH1A1GLAGAA
SCHEMBL28904610 0.88 MAPK13 (0.87) KDM4EKMT2AALDH1A1GLAGAA
SCHEMBL12561714 0.88 KDM4E (0.72) KDM4EKMT2AALDH1A1GLAGAA

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130165489-A1 Small Molecule Modulators of HIV-1 Capsid Stability and Methods Thereof THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2013-06-27 US claimed
WO-2011139637-A1 SMALL-MOLECULE MODULATORS OF HIV-1 CAPSID STABILITY AND METHODS THEREOF PHILADELPHIA HEALTH & EDUCATION CORPORATION (US) 2011-11-10 WO claimed
US-20070259875-A1 Triaryl substituted imidazole derivatives and taste-inhibiting uses thereof REDPOINT BIO CORPORATION 2007-11-08 US claimed
US-12590125-B2 Peptide inhibitors for the inhibition of HIV capsid THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2026-03-31 US disclosed
CN-114302735-B Peptide inhibitors for inhibiting HIV capsid 密苏里大学管理者 2025-03-18 CN disclosed
US-11935803-B2 Resin composition, laminate, semiconductor wafer with resin composition layer, substrate for mounting semiconductor with resin composition layer and semiconductor device MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2024-03-19 US disclosed
EP-4276106-A2 METHODS AND COMPOSITIONS FOR INDUCING AN IMMUNE RESPONSE USING CONSERVED ELEMENT CONSTRUCTS The United States of America as represented by the Secretary of the Department of Health and Human Services (US) 2023-11-15 EP disclosed
US-20230340029-A1 METHODS AND COMPOSITIONS FOR INDUCING AN IMMUNE RESPONSE USING CONSERVED ELEMENT CONSTRUCTS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2023-10-26 US disclosed
EP-3294755-B1 METHODS AND COMPOSITIONS FOR INDUCING AN IMMUNE RESPONSE USING CONSERVED ELEMENT CONSTRUCTS THE US SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-08-23 EP disclosed
US-20220306690-A1 PEPTIDE INHIBITORS FOR THE INHIBITION OF HIV CAPSID THE CURATORS OF THE UNIVERSITY OF MISSOURI 2022-09-29 US disclosed
CN-111635361-B Fluorescent compound and preparation method and application thereof 五邑大学 2022-08-02 CN disclosed
EP-2015638-A2 TRIARYL SUBSTITUTED IMIDAZOLE DERIVATIVES AND TASTE-INHIBITING USES THEREOF Redpoint Bio Corporation (US) 2009-01-21 EP disclosed
US-20070259875-A1 Triaryl substituted imidazole derivatives and taste-inhibiting uses thereof REDPOINT BIO CORPORATION 2007-11-08 US disclosed
US-20070259875-A1 Triaryl substituted imidazole derivatives and taste-inhibiting uses thereof REDPOINT BIO CORPORATION 2007-11-08 US disclosed
US-20070259875-A1 Triaryl substituted imidazole derivatives and taste-inhibiting uses thereof REDPOINT BIO CORPORATION 2007-11-08 US disclosed
WO-2007127479-A2 TRIARYL SUBSTITUTED IMIDAZOLE DERIVATIVES AND TASTE-INHIBITING USES THEREOF REDPOINT BIO CORPORATION (US) 2007-11-08 WO disclosed
WO-2007127479-A2 TRIARYL SUBSTITUTED IMIDAZOLE DERIVATIVES AND TASTE-INHIBITING USES THEREOF REDPOINT BIO CORPORATION (US) 2007-11-08 WO disclosed
US-20060058553-A1 Novel bicyclic hydroxamates as inhibitors of histone deacetylase AXYS PHARMACEUTICALS, INC. (US) 2006-03-16 US disclosed
EP-1472216-A2 NOVEL BICYCLIC HYDROXAMATES AS INHIBITORS OF HISTONE DEACETYLASE Axys Pharmaceuticals (US) 2004-11-03 EP disclosed
WO-2003066579-A2 NOVEL BICYCLIC HYDROXAMATES AS INHIBITORS OF HISTONE DEACETYLASE AXYS PHARMACEUTICALS (US) 2003-08-14 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 (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-20130165489-A1 Small Molecule Modulators of HIV-1 Capsid Stability and Methods Thereof ZC3HAV1, MAVS, HAVCR2 KDM4E 1542/4885KMT2A 3224/4885ALDH1A1 3672/4885
US-20070259875-A1 Triaryl substituted imidazole derivatives and taste-inhibiting uses thereof TAS1R3, TAS2R1, TAS1R1 KDM4E 3422/4885KMT2A 3144/4885ALDH1A1 407/4885
US-12590125-B2 Peptide inhibitors for the inhibition of HIV capsid VIP, QPCT, TPX2 KDM4E 1920/4885KMT2A 1300/4885ALDH1A1 4844/4885
US-20060058553-A1 Novel bicyclic hydroxamates as inhibitors of histone deacetylase HDAC1, HDAC2, HDAC11 KDM4E 418/4885KMT2A 100/4885ALDH1A1 1478/4885

“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.