SCHEMBL1234876

SCHEMBL1234876

C[Si](C)(C)CCOCn1nc(N)c2cc(-c3ccccc3)c(Cl)cc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 4/20 0.36
NPC1 O15118 2/20 0.35
SCN5A Q14524 2/20 0.34
ALOX5AP P20292 4/20 0.34
FEN1 P39748 4/20 0.34
EGFR P00533 1/20 0.32
IGF1R P08069 1/20 0.32
SRC P12931 1/20 0.32
FLT4 P35916 1/20 0.32
KDR P35968 1/20 0.32
FLT3 P36888 1/20 0.32
EPHB4 P54760 1/20 0.32
TEK Q02763 1/20 0.32
DGAT1 O75907 3/20 0.31
MAP4K4 O95819 1/20 0.31
PRKAB2 O43741 3/20 0.31
PRKAG1 P54619 3/20 0.31
PRKAA2 P54646 3/20 0.31
PRKAA1 Q13131 3/20 0.31
PRKAG3 Q9UGI9 3/20 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
SCHEMBL4496683 0.80 ACP1 (0.35)
SCHEMBL4488611 0.79 GSK3B (0.48) FLT4KDRFLT3
SCHEMBL1234014 0.79 GSK3B (0.52)
SCHEMBL1378240 0.78 ALOX5AP (0.38) SCN9ANPC1SCN5AALOX5APFEN1
SCHEMBL6486540 0.78 KMO (0.36) SCN9ANPC1SCN5ADGAT1
SCHEMBL13713049 0.78 SCN9A (0.40) SCN9ASCN5ACSNK2A1MEN1KMT2A
SCHEMBL4109728 0.77 NPC1 (0.45) SCN9ANPC1SCN5AALOX5APFEN1
SCHEMBL27604149 0.77 KDM4E (0.32) EGFRIGF1RSRCFLT4KDR
SCHEMBL2662090 0.76 NPC1 (0.34) SCN9ANPC1ALOX5APFEN1DGAT1
SCHEMBL3515098 0.74 MAPT (0.42) NPC1ALOX5APFEN1MEN1RAB9A

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
JP-2011026340-A INTERMEDIATE COMPOUND FOR SYNTHESIZING AMINO INDAZOLE DERIVATIVE USEFUL AS KINASE INHIBITOR AVENTIS PHARMA SA 2011-02-10 JP disclosed
US-7582669-B2 Aminoindazole derivatives as medicaments and pharmaceutical compositions including them AVENTIS PHARMA SA (FR) 2009-09-01 US disclosed
US-20070093479-A1 NOVEL AMINOINDAZOLE DERIVATIVES AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS INCLUDING THEM AVENTIS PHARMA S.A. (FR) 2007-04-26 US disclosed
US-7166629-B2 Aminoindazole derivatives as medicaments and pharmaceutical compositions including them AVENTIS PHARMA S.A. (FR) 2007-01-23 US disclosed
US-20040110956-A1 3-aminoindazole derivatives, e.g., N-butyl-6-chloro-5-phenyl-1H-indazol-3-amine; treating diseases involving phosphorylation of the tau protein such as Alzheimer's disease, Parkinson's disease, and frontoparietal dementia AVENTIS PHARMA S.A. (FR) 2004-06-10 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 (2 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-20070093479-A1 NOVEL AMINOINDAZOLE DERIVATIVES AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS INCLUDING THEM SUCNR1, CNR1, SIGMAR1 SCN9A 958/4885NPC1 1006/4885SCN5A 1483/4885
US-20040110956-A1 3-aminoindazole derivatives, e.g., N-butyl-6-chloro-5-phenyl-1H-indazol-3-amine; treating diseases involving phosphorylation of the tau protein such as Alzheimer's disease, Parkinson's disease, and frontoparietal dementia OXSR1, OXER1, OXGR1 SCN9A 1552/4885NPC1 1201/4885SCN5A 3048/4885

“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.