SCHEMBL9951389

SCHEMBL9951389

O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccccc1O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMPRSS4 Q9NRS4 3/20 0.74
MEN1 O00255 4/20 0.67
KMT2A Q03164 4/20 0.67
HTT P42858 3/20 0.67
KDM4E B2RXH2 2/20 0.67
LMNA P02545 2/20 0.67
MAPT P10636 2/20 0.67
GAA P10253 1/20 0.67
GRM4 Q14833 1/20 0.64
KDR P35968 1/20 0.62
P2RX1 P51575 2/20 0.61
P2RX4 Q99571 1/20 0.60
P2RX7 Q99572 1/20 0.60
HDAC3 O15379 1/20 0.60
EGFR P00533 1/20 0.60
HDAC4 P56524 1/20 0.60
HDAC1 Q13547 1/20 0.60
HDAC7 Q8WUI4 1/20 0.60
HDAC2 Q92769 1/20 0.60
HDAC10 Q969S8 1/20 0.60

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
SCHEMBL12835410 0.86 GRM4 (0.64) TMPRSS4MEN1KMT2AHTTKDM4E
SCHEMBL18804918 0.85 GRM4 (0.63) TMPRSS4MEN1KMT2AHTTKDM4E
SCHEMBL17154495 0.85 GRM4 (0.63) TMPRSS4MEN1KMT2AHTTLMNA
SCHEMBL5665935 0.85 FADS1 (0.66) TMPRSS4MEN1KMT2AHTTLMNA
SCHEMBL330128 0.85 TMPRSS4 (1.00) TMPRSS4MEN1KMT2AKDRP2RX1
SCHEMBL22339323 0.85 TMPRSS4 (0.64) TMPRSS4MEN1KMT2AHTTKDM4E
SCHEMBL8855725 0.84 GRM4 (0.62) TMPRSS4MEN1KMT2AHTTKDM4E
SCHEMBL330566 0.83 TMPRSS4 (0.77) TMPRSS4MEN1KMT2AHTTKDM4E
SCHEMBL330383 0.83 TMPRSS4 (0.77) TMPRSS4MEN1KMT2AHTTLMNA
SCHEMBL28093056 0.83 PTGS1 (0.72) MEN1KMT2AHTTKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106432137-B Histone acetyltransferase modulators and uses thereof 纽约市哥伦比亚大学理事会 2020-11-06 CN disclosed
EP-3323813-B1 HISTONE ACETYLTRANSFERASE MODULATORS AND USES THEREOF UNIV COLUMBIA (US) 2020-08-26 EP disclosed
EP-3323813-B1 HISTONE ACETYLTRANSFERASE MODULATORS AND USES THEREOF UNIV COLUMBIA (US) 2020-08-26 EP disclosed
US-20180244603-A1 HISTONE ACETYLTRANSFERASE MODULATORS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2018-08-30 US disclosed
EP-3323813-A1 HISTONE ACETYLTRANSFERASE MODULATORS AND USES THEREOF The Trustees of Columbia University in the City of New York (US) 2018-05-23 EP disclosed
EP-3323813-A1 HISTONE ACETYLTRANSFERASE MODULATORS AND USES THEREOF The Trustees of Columbia University in the City of New York (US) 2018-05-23 EP disclosed
US-9969677-B2 Histone acetyltransferase modulators and uses thereof THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2018-05-15 US disclosed
US-9969677-B2 Histone acetyltransferase modulators and uses thereof THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2018-05-15 US disclosed
US-9969677-B2 Histone acetyltransferase modulators and uses thereof THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2018-05-15 US disclosed
EP-2654428-B1 HISTONE ACETYLTRANSFERASE MODULATORS AND USESE THEREOF UNIV COLUMBIA (US) 2018-02-14 EP disclosed
US-20170121276-A1 HISTONE ACETYLTRANSFERASE MODULATORS AND USES THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2017-05-04 US disclosed
CN-106432137-A Histone acetyltransferase modulators and uses thereof 纽约市哥伦比亚大学理事会 2017-02-22 CN disclosed
CN-103347392-B Histone acetyltransferase modulators and uses thereof 纽约市哥伦比亚大学理事会 2016-10-12 CN disclosed
US-20150210717-A1 SPECIFIC INHIBITORS OF PROTEIN P21 AS THERAPEUTIC AGENTS LEIBNIZ-INSTITUT FÜR ALTERSFORSCHUNG (DE) 2015-07-30 US disclosed
WO-2014041125-A1 SPECIFIC INHIBITORS OF PROTEIN P21 AS THERAPEUTIC AGENTS BADEN-WÜRTTEMBERG STIFTUNG GMBH (DE) 2014-03-20 WO disclosed
EP-2654428-A1 HISTONE ACETYLTRANSFERASE MODULATORS AND USESE THEREOF The Trustees of Columbia University in the City of New York (US) 2013-10-30 EP disclosed
CN-103347392-A Histone acetyltransferase modulators and uses thereof UNIV COLUMBIA 2013-10-09 CN disclosed
WO-2012088420-A1 HISTONE ACETYLTRANSFERASE MODULATORS AND USESE THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2012-06-28 WO disclosed
WO-2012088420-A1 HISTONE ACETYLTRANSFERASE MODULATORS AND USESE THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2012-06-28 WO disclosed
CN-102276500-A Salicylamide antineoplastic compounds, synthesizing method thereof, and purpose thereof 2011-12-14 CN 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 (3 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-20180244603-A1 HISTONE ACETYLTRANSFERASE MODULATORS AND USES THEREOF EP300, HTT, KAT2A TMPRSS4 2854/4885MEN1 2622/4885KMT2A 50/4885
US-20170121276-A1 HISTONE ACETYLTRANSFERASE MODULATORS AND USES THEREOF EP300, KAT2A, HTT TMPRSS4 2804/4885MEN1 2596/4885KMT2A 51/4885
US-20150210717-A1 SPECIFIC INHIBITORS OF PROTEIN P21 AS THERAPEUTIC AGENTS CDKN1A, ING2, BCCIP TMPRSS4 3989/4885MEN1 2917/4885KMT2A 2523/4885

“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.