SCHEMBL4293264

SCHEMBL4293264

Cc1cc(C(=O)Nc2cccc(Oc3ccc(NC(=S)NC(=O)O)nc3)c2)n(C)n1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.53
PDGFRB P09619 5/20 0.53
KIT P10721 5/20 0.53
FLT1 P17948 5/20 0.53
AURKA O14965 4/20 0.53
BRAF P15056 2/20 0.52
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
HIF1A Q16665 1/20 0.48
GAA P10253 1/20 0.42
CDK8 P49336 3/20 0.42
MET P08581 1/20 0.41
FGFR1 P11362 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
SCHEMBL3681543 0.91 KDR (0.49) KDRPDGFRBKITFLT1AURKA
SCHEMBL4286386 0.89 KDR (0.50) KDRPDGFRBKITFLT1AURKA
SCHEMBL4280386 0.86 KDR (0.52) KDRPDGFRBKITFLT1AURKA
SCHEMBL13639016 0.86 KDR (0.48) KDRPDGFRBKITFLT1AURKA
SCHEMBL4285694 0.85 KDR (0.51) KDRPDGFRBKITFLT1AURKA
SCHEMBL3673895 0.82 CDK8 (0.62) KDRPDGFRBKITFLT1AURKA
SCHEMBL4360369 0.82 BRAF (0.55) KDRPDGFRBKITFLT1AURKA
SCHEMBL13636105 0.80 KDR (0.47) KDRPDGFRBKITFLT1AURKA
SCHEMBL3668920 0.80 PDGFRB (0.53) KDRPDGFRBKITFLT1AURKA
SCHEMBL4280855 0.80 MET (0.43) KITALDH1A1MEN1KMT2ALMNA

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
EP-2162445-B1 HETEROBICYCLIC COMPOUNDS AS KINASE INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2013-11-27 EP disclosed
US-8304557-B2 Fused heterocycle derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-11-06 US disclosed
US-20090163488-A1 FUSED HETEROCYCLE DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-25 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-20090163488-A1 FUSED HETEROCYCLE DERIVATIVES AND USE THEREOF NOX3, NOX5, ZYX KDR 2311/4885PDGFRB 3323/4885KIT 2730/4885

“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.