SCHEMBL5459658

SCHEMBL5459658

FC(F)(F)c1cc(Br)c2[nH]c(Nc3ccc(Oc4cccn5ccnc45)cc3)nc2c1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRAF P15056 7/20 0.38
RAF1 P04049 3/20 0.38
PDE10A Q9Y233 6/20 0.38
CSNK1A1 P48729 2/20 0.38
CSNK1D P48730 2/20 0.38
GSK3B P49841 1/20 0.38
CSNK1G2 P78368 1/20 0.38
KDR P35968 5/20 0.36
DYRK1A Q13627 1/20 0.33
DYRK1B Q9Y463 1/20 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
SCHEMBL5450821 0.90 KDR (0.41) BRAFRAF1PDE10ACSNK1A1CSNK1D
SCHEMBL4812783 0.72 TRPV1 (0.47) PDE10ACSNK1A1CSNK1DGSK3BCSNK1G2
SCHEMBL5456410 0.72 MAPT (0.39) BRAFRAF1KDR
SCHEMBL5449915 0.71 PDE10A (0.34) BRAFRAF1PDE10ACSNK1A1CSNK1D
SCHEMBL5763116 0.69 RAF1 (0.32) BRAFRAF1PDE10ACSNK1A1CSNK1D
SCHEMBL5452404 0.69 PIM1 (0.37) BRAFRAF1PDE10ACSNK1A1CSNK1D
SCHEMBL5457073 0.69 RIPK1 (0.36) BRAFRAF1PDE10ACSNK1A1CSNK1D
SCHEMBL5444075 0.68 KDR (0.41) BRAFRAF1PDE10ACSNK1A1CSNK1D
SCHEMBL4170603 0.67 KDR (0.52) BRAFRAF1PDE10ACSNK1A1CSNK1D
SCHEMBL5444098 0.67 KDM4E (0.46) BRAFRAF1KDR

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-20070021456-A1 Aminobenzimidazole derivatives MERCK PATENT GMBH (DE) 2007-01-25 US claimed
EP-1656377-A1 AMINOBENZIMIDAZOLE DERIVATIVES MERCK PATENT GmbH (DE) 2006-05-17 EP claimed
WO-2005019216-A1 AMINOBENZIMIDAZOLE DERIVATIVES MERCK PATENT GMBH (DE) 2005-03-03 WO claimed
US-20070021456-A1 Aminobenzimidazole derivatives MERCK PATENT GMBH (DE) 2007-01-25 US disclosed
US-20070021456-A1 Aminobenzimidazole derivatives MERCK PATENT GMBH (DE) 2007-01-25 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-20070021456-A1 Aminobenzimidazole derivatives TIE1, KDR, FLT1 BRAF 22/4885RAF1 17/4885PDE10A 4420/4885

“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.