SCHEMBL723480

SCHEMBL723480

CS(=O)(=O)c1cncc(-c2ccnc3cc(-c4ccc(CCO)cc4)oc23)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 1/20 0.39
PTGS2 P35354 8/20 0.37
PIK3CA P42336 2/20 0.34
PIK3CD O00329 1/20 0.34
PIK3CB P42338 1/20 0.34
PI4KA P42356 1/20 0.34
PIK3CG P48736 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
PTGS1 P23219 3/20 0.34
MAPKAPK2 P49137 2/20 0.33

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
SCHEMBL15216703 0.87 PIK3C3 (0.38) PIK3C3PTGS2PIK3CAPIK3CDPIK3CB
SCHEMBL723620 0.83 CYP3A4 (0.38) PIK3C3
SCHEMBL723393 0.82 MAPKAPK2 (0.35) PIK3CAMAPKAPK2
SCHEMBL723599 0.81 PIK3CA (0.43) PIK3CAMAPKAPK2
SCHEMBL15216713 0.80 USP7 (0.36) MAPKAPK2
SCHEMBL723291 0.80 PIK3C3 (0.36) PIK3C3PIK3CAPIK3CDPIK3CBPI4KA
SCHEMBL725130 0.80 PIK3C3 (0.36) PIK3C3PTGS2PIK3CAPIK3CDPIK3CB
SCHEMBL725211 0.80 CCNC (0.40) PIK3C3PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL723677 0.79 TNKS (0.38) PIK3C3
SCHEMBL30765246 0.78 BRD4 (0.40) PIK3C3PIK3CAPIK3CDPIK3CBPI4KA

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-2609100-B1 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2015-06-24 EP claimed
EP-2609100-A2 FUROPYRIDINE DERIVATIVES Merck Patent GmbH (DE) 2013-07-03 EP claimed
CN-103052640-A Furopyridine derivatives MERCK PATENT GMBH 2013-04-17 CN claimed
WO-2012025187-A2 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 WO claimed
EP-2609100-B1 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2015-06-24 EP disclosed
US-9006440-B2 Furopyridine derivatives MERCK PATENT GMBH (DE) 2015-04-14 US disclosed
US-9006440-B2 Furopyridine derivatives MERCK PATENT GMBH (DE) 2015-04-14 US disclosed
US-20130225569-A1 FUROPYRIDINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 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 (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-20130225569-A1 FUROPYRIDINE DERIVATIVES SYK, FCGRT, SSB PIK3C3 123/4885PTGS2 782/4885PIK3CA 1186/4885

“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.