SCHEMBL2897732

SCHEMBL2897732

Cc1sc2[nH]c(=O)cc(O)c2c1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.55
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HPGD P15428 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
RXFP1 Q9HBX9 1/20 0.43
QPCT Q16769 1/20 0.43
LMNA P02545 1/20 0.42
ATM Q13315 1/20 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
SCHEMBL1190927 0.78
SCHEMBL1191057 0.75 PRKAG1 (0.48) ALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL5788988 0.75 ALDH1A1 (0.56) HTTALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL1191219 0.74
SCHEMBL4476710 0.74 ALDH1A1 (0.46) ALDH1A1KDM4ESMN1; SMN2HPGDRXFP1
SCHEMBL1190425 0.72 ALDH1A1 (0.57) ALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL2329966 0.72 HTT (1.00) HTTALDH1A1KDM4EL3MBTL1RXFP1
SCHEMBL1040106 0.71
SCHEMBL2902729 0.71 MAPT (0.55) HTTALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL2897388 0.71 PRKAB2 (0.47) HTTALDH1A1KDM4ESMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8193215-B2 Thieno[2 3-b]pyridines as potassium channel inhibitors XENTION LIMITED (GB) 2012-06-05 US disclosed
EP-1879899-B1 THIENOPYRIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS XENTION LTD (GB) 2010-08-04 EP disclosed
US-20100041695-A1 Thieno[2,3-b]pyridines as Potassium Channel Inhibitors XENTION LIMITED (GB) 2010-02-18 US disclosed
US-7576212-B2 Thieno[2,3-B] pyridines as potassium channel inhibitors XENTION LIMITED (GB) 2009-08-18 US disclosed
EP-1879899-A1 THIENOPYRIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS Xention Discovery Limited (GB) 2008-01-23 EP disclosed
US-20060183768-A1 Compounds XENTION DISCOVERY LTD. (GB) 2006-08-17 US disclosed
WO-2006061642-A1 COMPOUNDS XENTION DISCOVERY LIMITED (GB) 2006-06-15 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-20100041695-A1 Thieno[2,3-b]pyridines as Potassium Channel Inhibitors SCN8A, SCN1B, SCN2B HTT 3498/4885ALDH1A1 3155/4885KDM4E 2290/4885
US-20060183768-A1 Compounds SCN7A, CBR3, SCN8A HTT 2632/4885ALDH1A1 2799/4885KDM4E 3169/4885

“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.