SCHEMBL14907948

SCHEMBL14907948

CC(C)(C)OC(=O)NCc1ccc(O)c(N)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.52
ALDH1A1 P00352 1/20 0.52
GFER P55789 1/20 0.52
HDAC1 Q13547 2/20 0.51
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
HPN P05981 1/20 0.46
GRM2 Q14416 1/20 0.45
GLS O94925 1/20 0.45
NAMPT P43490 2/20 0.44
KDM4A O75164 1/20 0.44
TSHR P16473 1/20 0.43
ERCC1 P07992 1/20 0.42
ERCC4 Q92889 1/20 0.42
SDCBP O00560 1/20 0.41
SDC2 P34741 1/20 0.41

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
SCHEMBL31431581 0.89 HDAC1 (0.48) GAAHDAC1CA1CA2L3MBTL1
SCHEMBL7407052 0.88 HDAC1 (0.48) GAAHDAC1CA1CA2L3MBTL1
SCHEMBL16392318 0.87 HDAC1 (0.47) GAAHDAC1CA1CA2L3MBTL1
SCHEMBL5749285 0.87 ERCC1 (0.56) GAAHDAC1CA1CA2L3MBTL1
SCHEMBL21307485 0.86 CA2 (0.53) GAAALDH1A1GFERCA1CA2
SCHEMBL31096887 0.84 GRM2 (0.49) GAAHDAC1CA1CA2L3MBTL1
SCHEMBL29726397 0.84 GRM2 (0.49) GAAHDAC1CA1CA2L3MBTL1
SCHEMBL3101649 0.84 TSHR (0.56) GAAALDH1A1HDAC1CA1CA2
SCHEMBL6681923 0.84 ALDH1A1 (0.52) GAAALDH1A1HDAC1L3MBTL1TSHR
SCHEMBL14144563 0.84 HDAC1 (0.52) GAAHDAC1CA1CA2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9174984-B2 Chemical compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2015-11-03 US disclosed
US-20140296204-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2014-10-02 US disclosed
WO-2013062945-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2013-05-02 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 (1 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-20140296204-A1 CHEMICAL COMPOUNDS DNMT1, DNMT3A, DNMT3B GAA 1898/4885ALDH1A1 1016/4885GFER 2800/4885

“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.