SCHEMBL4282310

SCHEMBL4282310

Cn1ccc2ncnc(Oc3cccc(NC(=O)c4ccccc4)c3)c21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 19/20 1.00
AURKA O14965 1/20 0.55
PDGFRB P09619 1/20 0.55
KIT P10721 1/20 0.55
BRAF P15056 1/20 0.55
PDGFRA P16234 1/20 0.55
FLT1 P17948 1/20 0.55
TEK Q02763 1/20 0.55
PTK2 Q05397 1/20 0.55
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
NLRP3 Q96P20 1/20 0.52

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
SCHEMBL4283106 0.94 KDR (1.00) KDRAURKAPDGFRBKITBRAF
SCHEMBL4292698 0.89 KDR (1.00) KDRAURKAPDGFRBKITBRAF
SCHEMBL4285345 0.88 KDR (0.92) KDR
SCHEMBL13856544 0.85 KDR (0.74) KDR
Hydrochloric Acid SCHEMBL4292597 0.84 KDR (0.72) KDR
SCHEMBL4283768 0.83 KDR (0.74) KDRAURKAPDGFRBKITBRAF
SCHEMBL4291635 0.79 KDR (1.00) KDR
SCHEMBL4769891 0.78 KDR (0.76) KDRAURKAPDGFRBKITBRAF
SCHEMBL4281418 0.77 KDR (0.80) KDRAURKAPDGFRBKITBRAF
SCHEMBL4286015 0.76 KDR (1.00) KDRAURKAPDGFRBKITBRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090137580-A1 Fused Heterocyclic Derivatives and Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-28 US disclosed
US-20090137580-A1 Fused Heterocyclic Derivatives and Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-28 US disclosed
US-20090137580-A1 Fused Heterocyclic Derivatives and Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-28 US disclosed
EP-1904498-A1 FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2008-04-02 EP disclosed
WO-2007004749-A1 FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-11 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 (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-20090137580-A1 Fused Heterocyclic Derivatives and Use Thereof TIE1, KDR, FLT1 KDR 2/4885AURKA 186/4885PDGFRB 6/4885

“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.