SCHEMBL2644580

SCHEMBL2644580

COc1ccccc1-c1cnc(N)cn1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 15/20 0.68
FEN1 P39748 15/20 0.68
HSP90AA1 P07900 2/20 0.50
METAP2 P50579 1/20 0.50
HSP90AB1 P08238 1/20 0.49
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL15917674 0.82 FEN1 (1.00) ALOX5APFEN1
SCHEMBL29685241 0.81 ALDH1A1 (0.53) ALOX5APFEN1HSP90AA1METAP2HSP90AB1
SCHEMBL29739505 0.79 HSP90AA1 (0.50) ALOX5APFEN1HSP90AA1METAP2HSP90AB1
SCHEMBL14988502 0.79 HSP90AA1 (0.50) ALOX5APFEN1HSP90AA1METAP2HSP90AB1
SCHEMBL5550517 0.79 ALOX5AP (0.53) ALOX5APFEN1
SCHEMBL6075271 0.79 ALOX5AP (0.53) ALOX5APFEN1
SCHEMBL27990067 0.78 HSP90AA1 (0.53) ALOX5APFEN1HSP90AA1METAP2HSP90AB1
SCHEMBL15915519 0.78 ALOX5AP (0.56) ALOX5APFEN1
SCHEMBL8259696 0.78 FEN1 (0.52) ALOX5APFEN1
SCHEMBL28107573 0.77 FEN1 (0.66) ALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100457757-C Novel spiro compounds BANYU PHARMA CO LTD (JP) 2009-02-04 CN disclosed
EP-1572670-B1 5-SUBSTITUTED-PYRAZINE OR -PYRIDINE GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2007-08-22 EP disclosed
US-7132425-B2 5-substituted-six-membered heteroaromatic glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2006-11-07 US disclosed
EP-1572670-A1 5-SUBSTITUTED-PYRAZINE OR -PYRIDINE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2005-09-14 EP disclosed
CN-1640877-A Novel spiro compounds BANYU PHARMA CO LTD (JP) 2005-07-20 CN disclosed
CN-1202108-C Spiro compounds, processes and intermediates BANYU PHARMA CO LTD (JP) 2005-05-18 CN disclosed
US-20040147748-A1 5-Substituted-six-membered heteroaromatic glucokinase activators CHEN SHAOQING (US) 2004-07-29 US disclosed
WO-2004052869-A1 5-SUBSTITUTED-PYRAZINE OR PYRIDINE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2004-06-24 WO disclosed
CN-1370168-A Novel spiro compounds BANYU PHARMA CO LTD (JP) 2002-09-18 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 (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-20040147748-A1 5-Substituted-six-membered heteroaromatic glucokinase activators GCK, GCKR, GALK1 ALOX5AP 3219/4885FEN1 4364/4885HSP90AA1 2313/4885

“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.