SCHEMBL5459640

SCHEMBL5459640

FC(F)(F)c1cc(Br)c2nc(Nc3ccc(OC4=CC5=CNSN5C=C4)cc3)[nH]c2c1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.39
RAF1 P04049 1/20 0.32
BRAF P15056 1/20 0.32
PDE10A Q9Y233 2/20 0.31
CSNK1A1 P48729 1/20 0.31
CSNK1D P48730 1/20 0.31
GSK3B P49841 1/20 0.31
CSNK1G2 P78368 1/20 0.31
KDR P35968 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
TTBK1 Q5TCY1 2/20 0.31
TTBK2 Q6IQ55 2/20 0.31

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
SCHEMBL5447170 0.92 RAF1 (0.33) RAF1BRAFPDE10ACSNK1A1CSNK1D
SCHEMBL5449919 0.90 KDR (0.36) RAF1BRAFPDE10ACSNK1A1CSNK1D
SCHEMBL5765454 0.89 RIPK1 (0.39) RIPK1KDR
SCHEMBL5444133 0.85 RIPK1 (0.38) RIPK1KDREGLN1
SCHEMBL5447942 0.85 RIPK1 (0.38) RIPK1RAF1BRAFPDE10ACSNK1A1
SCHEMBL5465689 0.85 RIPK1 (0.41) RIPK1EGLN1
SCHEMBL5465648 0.84 PDE10A (0.36) PDE10ACSNK1A1CSNK1D
SCHEMBL5447379 0.84 PDE10A (0.33) PDE10ACSNK1A1CSNK1D
SCHEMBL5453176 0.80 RIPK1 (0.38) RIPK1RAF1BRAFPDE10ACSNK1A1
SCHEMBL5444095 0.80 CSNK1D (0.38) RAF1BRAFPDE10ACSNK1A1CSNK1D

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
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

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 RIPK1 1867/4885RAF1 17/4885BRAF 22/4885

“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.