SCHEMBL9952137

SCHEMBL9952137

O=C1N=CCc2cccc(O)c21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.48
ALDH1A1 P00352 4/20 0.48
ALOX15 P16050 4/20 0.48
HSD17B10 Q99714 4/20 0.48
TDP1 Q9NUW8 4/20 0.48
KMT2A Q03164 4/20 0.48
USP2 O75604 3/20 0.48
MEN1 O00255 3/20 0.48
CYP3A4 P08684 3/20 0.48
TSHR P16473 2/20 0.48
THRB P10828 2/20 0.48
HPN P05981 1/20 0.48
ALOX5 P09917 1/20 0.48
PTGS1 P23219 1/20 0.48
PDE4A P27815 1/20 0.48
KDR P35968 1/20 0.48
SIRT5 Q9NXA8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HRH3 Q9Y5N1 1/20 0.48
MAOA P21397 4/20 0.40

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
SCHEMBL4006300 0.73 MAOA (0.47) ALDH1A1HSD17B10KMT2AMEN1MAOA
SCHEMBL4350460 0.72 BCL2L1 (0.38) MAPTALDH1A1ALOX15HSD17B10TDP1
SCHEMBL11412574 0.70 MAPT (0.48) MAPTALDH1A1ALOX15HSD17B10TDP1
SCHEMBL831827 0.70 PARP1 (0.46) MAPTALDH1A1ALOX15HSD17B10TDP1
SCHEMBL57213 0.68 CA12 (0.42) KMT2AMEN1TSHRMAOAMAOB
SCHEMBL29824315 0.68 CA12 (0.42) KMT2AMEN1TSHRMAOAMAOB
SCHEMBL23728394 0.68 MAPT (0.50) MAPTALDH1A1ALOX15HSD17B10TDP1
SCHEMBL3099042 0.67 CA12 (0.41) KMT2AMEN1TSHRMAOAMAOB
Hydrochloric Acid SCHEMBL2455497 0.67 CA12 (0.41) KMT2AMEN1TSHRMAOAMAOB
Hydrochloric Acid SCHEMBL7005883 0.67 CA12 (0.41) KMT2AMEN1TSHRMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
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
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

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-20180244603-A1 HISTONE ACETYLTRANSFERASE MODULATORS AND USES THEREOF EP300, HTT, KAT2A MAPT 8/4885ALDH1A1 2027/4885ALOX15 3193/4885
US-20170121276-A1 HISTONE ACETYLTRANSFERASE MODULATORS AND USES THEREOF EP300, KAT2A, HTT MAPT 8/4885ALDH1A1 2114/4885ALOX15 3114/4885

“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.