SCHEMBL4286488

SCHEMBL4286488

Nc1nc2ccc(Oc3ccc(F)c(NC(=O)O)c3)cn2n1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 16/20 0.51
PDGFRB P09619 3/20 0.51
AURKA O14965 2/20 0.51
KIT P10721 2/20 0.51
FLT1 P17948 2/20 0.51
FGFR1 P11362 1/20 0.51
PDGFRA P16234 1/20 0.51
TEK Q02763 3/20 0.37
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
BRAF P15056 1/20 0.36
KDM4E B2RXH2 1/20 0.35
RIPK1 Q13546 1/20 0.35

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
SCHEMBL4280681 0.88 KDR (0.57) KDRPDGFRBAURKAKITFLT1
SCHEMBL4285985 0.87 KDR (0.45) KDRPDGFRBAURKAKITFLT1
SCHEMBL13636152 0.86 KDR (0.47) KDRPDGFRBAURKAKITFLT1
SCHEMBL4282108 0.84 KDR (0.72) KDRPDGFRBAURKAKITFLT1
SCHEMBL2858588 0.81 KDR (0.50) KDRPDGFRBAURKAKITFLT1
SCHEMBL14060824 0.76 PIK3CG (0.44)
SCHEMBL13636141 0.76 KDR (0.52) KDRPDGFRBAURKAKITFLT1
SCHEMBL2860043 0.75 KDR (0.52) KDRPDGFRBAURKAKITFLT1
SCHEMBL4291620 0.74 KDR (0.71) KDRPDGFRBAURKAKITFLT1
SCHEMBL13636158 0.73 KDR (0.41) KDRPDGFRBAURKAKITFLT1

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 3323/4885AURKA 3114/4885

“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.