SCHEMBL2921041

SCHEMBL2921041

CC(=O)OCc1nc2sc3c(c2c(=O)n1-c1ccccc1)CCCC3

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.59
KDM4E B2RXH2 4/20 0.58
POLB P06746 4/20 0.58
MAPT P10636 2/20 0.58
GAA P10253 1/20 0.58
ALDH1A1 P00352 7/20 0.54
HTT P42858 2/20 0.54
KMT2A Q03164 5/20 0.53
MEN1 O00255 4/20 0.53
TP53 P04637 1/20 0.53
LMNA P02545 1/20 0.52
RECQL P46063 1/20 0.50
CTDSP1 Q9GZU7 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
BLM P54132 1/20 0.49
HSD17B10 Q99714 1/20 0.49
L3MBTL1 Q9Y468 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
SCHEMBL2924510 0.88 MAPT (0.62) NPSR1KDM4EPOLBMAPTGAA
SCHEMBL2923288 0.84 KMT2A (0.61) NPSR1POLBMAPTGAAALDH1A1
SCHEMBL2918271 0.84 POLB (0.69) NPSR1KDM4EPOLBMAPTGAA
SCHEMBL2924778 0.80 KDM4E (0.63) NPSR1KDM4EPOLBMAPTGAA
SCHEMBL2919879 0.78 ALDH1A1 (0.75) NPSR1KDM4EPOLBMAPTGAA
SCHEMBL13407753 0.76 MAPT (0.78) NPSR1KDM4EPOLBMAPTGAA
SCHEMBL2927326 0.73 KDM4E (0.46) NPSR1KDM4EPOLBMAPTGAA
SCHEMBL2920564 0.73 ALDH1A1 (0.72) NPSR1KDM4EPOLBMAPTGAA
SCHEMBL2924717 0.73 ALDH1A1 (0.57) NPSR1KDM4EPOLBMAPTGAA
SCHEMBL4146568 0.72 MAPT (0.64) NPSR1KDM4EPOLBMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1635839-B1 BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONES AND THEIR USE IN THERAPY ABBOTT HEALTHCARE PRODUCTS BV (NL) 2010-09-01 EP disclosed
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 US disclosed
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 US disclosed
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 US disclosed
EP-1635839-A2 BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONES AND THEIR USE IN THERAPY Solvay Pharmaceuticals B.V. (NL) 2006-03-22 EP disclosed
US-20050176742-A1 Novel compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2005-08-11 US disclosed
WO-2005032527-A2 BENZO (4, 5) THIENO (2, 3-D) PYRIMIDIN-4-ONES AND THEIR USE IN THERAPY SOLVAY PHARMACEUTICALS B.V. (NL) 2005-04-14 WO disclosed
US-20050038053-A1 Novel compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2005-02-17 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-20050176742-A1 Novel compounds and their use in therapy HSD17B11, HSD17B2, HSD17B1 NPSR1 1796/4885KDM4E 2665/4885POLB 1479/4885
US-20050038053-A1 Novel compounds and their use in therapy HSD17B11, HSD17B2, HSD17B1 NPSR1 1796/4885KDM4E 2665/4885POLB 1479/4885

“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.