SCHEMBL3109433

SCHEMBL3109433

CC(Oc1ccc(N)cc1)c1c(F)ccc(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 6/20 0.36
MAPK1 P28482 1/20 0.36
ALDH1A1 P00352 4/20 0.35
CYP3A4 P08684 2/20 0.35
INPPL1 O15357 4/20 0.34
TSHR P16473 2/20 0.34
APP P05067 1/20 0.34
MET P08581 4/20 0.33
SRC P12931 2/20 0.33
KDR P35968 2/20 0.33
TEAD4 Q15561 1/20 0.33
KIT P10721 1/20 0.33
FGFR2 P21802 1/20 0.33
AXL P30530 1/20 0.33
FLT3 P36888 1/20 0.33
MST1R Q04912 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL3099533 0.89 INPPL1 (0.43) INPPL1METSRCKDRKIT
SCHEMBL3099359 0.89 TEAD4 (0.34) TDP1MAPK1ALDH1A1CYP3A4INPPL1
SCHEMBL3104697 0.81 MET (0.47) INPPL1METSRCKDRKIT
SCHEMBL3101643 0.80 MET (0.40) INPPL1METSRCKDRKIT
SCHEMBL3093360 0.78 MET (0.56) INPPL1METSRCKDRKIT
SCHEMBL3094219 0.76 HSPB1 (0.45) MAPK1ALDH1A1CYP3A4APPMAPT
SCHEMBL3107120 0.72 CYP3A4 (0.53) MAPK1ALDH1A1CYP3A4TSHRMET
SCHEMBL13577189 0.71 ALDH1A1 (0.41) ALDH1A1CYP3A4INPPL1METSRC
SCHEMBL3102794 0.70 TDP1 (0.38) TDP1MAPK1ALDH1A1CYP3A4TSHR
SCHEMBL13577013 0.70 MET (0.40) INPPL1METSRCKDRKIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188078-B2 6-aryl/heteroalkyloxy benzothiazole and benzimidazole derivatives, method for preparing same, application thereof as drugs, pharmaceutical compositions and novel use in particular as C-MET inhibitors SANOFI-AVENTIS (FR) 2012-05-29 US disclosed
US-20100273793-A1 6-ARYL/HETEROALKYLOXY BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, APPLICATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS AND NOVEL USE IN PARTICULAR AS c-MET INHIBITORS SANOFI-AVENTIS (FR) 2010-10-28 US disclosed
EP-2205568-A1 6-ARYL/HETEROALKYLOXY BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, APPLICATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS AND NOVEL USE IN PARTICULAR AS C-MET INHIBITORS Sanofi-Aventis (FR) 2010-07-14 EP disclosed
WO-2009087305-A1 6-ARYL/HETEROALKYLOXY BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, APPLICATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS AND NOVEL USE IN PARTICULAR AS C-MET INHIBITORS SANOFI-AVENTIS (FR) 2009-07-16 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-20100273793-A1 6-ARYL/HETEROALKYLOXY BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, APPLICATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS AND NOVEL USE IN PARTICULAR AS c-MET INHIBITORS MET, ALK, JAK2 TDP1 4513/4885MAPK1 1510/4885ALDH1A1 698/4885

“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.