SCHEMBL3106716

SCHEMBL3106716

CC(Oc1ccc2nc(NC(=O)N(CCC3CCN(Cc4ccccc4)CC3)N(C(=O)NCCC3CCCN3C)c3nc4ccc(OC(C)c5c(Cl)ccc(F)c5Cl)cc4s3)sc2c1)c1c(Cl)ccc(F)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.41
MET P08581 3/20 0.38
CASR P41180 3/20 0.37
CHRM2 P08172 2/20 0.36
CHRM1 P11229 2/20 0.36
CHRM5 P08912 1/20 0.36
CHRM3 P20309 1/20 0.36
CHRM4 P08173 3/20 0.35
CASP3 P42574 1/20 0.35
ACHE P22303 3/20 0.34
BCHE P06276 2/20 0.34

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
SCHEMBL3106725 0.88 LCK (0.51) LCKMETCHRM2CHRM1CHRM5
SCHEMBL3102006 0.82 CHRM4 (0.47) METCHRM2CHRM1CHRM5CHRM3
SCHEMBL3110049 0.81 LCK (0.57) LCKMET
SCHEMBL3109350 0.77 ABL1 (0.48) MET
SCHEMBL3102206 0.77 ABL1 (0.46) LCKMET
SCHEMBL3652683 0.73 MET (0.43) LCKMET
SCHEMBL3112536 0.73 LCK (0.53) LCKMETCHRM3
SCHEMBL3102959 0.72 MET (0.51) LCKMET
SCHEMBL3114877 0.71 MET (0.50) LCKMET
SCHEMBL3104641 0.70 MET (0.40) LCKMET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 LCK 330/4885MET 1/4885CASR 797/4885

“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.