SCHEMBL3105185

SCHEMBL3105185

CC(Oc1ccc2nc(-c3ccccc3OC(N)=O)sc2c1)c1c(F)ccc(F)c1F

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.42
APP P05067 2/20 0.37
MAPT P10636 3/20 0.37
TP53 P04637 2/20 0.37
MET P08581 1/20 0.36
KDR P35968 1/20 0.36
RAB9A P51151 2/20 0.36
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
CA2 P00918 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL3112476 0.94 DYRK1A (0.41) DYRK1AAPPMAPTTP53MET
SCHEMBL3093433 0.93 DYRK1A (0.42) DYRK1AMETKDRRAB9A
SCHEMBL3104751 0.93 DYRK1A (0.43) DYRK1AAPPMAPTTP53RAB9A
SCHEMBL3104156 0.90 MET (0.43) DYRK1AMAPTTP53METKDR
SCHEMBL3101786 0.89 DYRK1A (0.40) DYRK1AAPPMAPTTP53MET
SCHEMBL3108703 0.88 MET (0.51) METKDR
SCHEMBL3099130 0.85 DYRK1A (0.43) DYRK1AMAPTTP53METKDR
SCHEMBL3110149 0.85 DYRK1A (0.43) DYRK1AAPPMAPTTP53RAB9A
SCHEMBL3105198 0.85 APP (0.47) APPMAPTTP53METKDR
SCHEMBL3104387 0.85 DYRK1A (0.46) DYRK1AMAPTTP53CA2RXFP1

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 2 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

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 DYRK1A 979/4885APP 4658/4885MAPT 2894/4885

“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.