SCHEMBL6154459

SCHEMBL6154459

CCOc1cc(NC(=O)OC(C)(C)C)ccc1Br

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.45
MAPT P10636 4/20 0.45
TP53 P04637 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 2/20 0.44
GAA P10253 1/20 0.44
RORC P51449 1/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA9 Q16790 1/20 0.43
CYP17A1 P05093 1/20 0.42
RAB9A P51151 1/20 0.42
GRM4 Q14833 1/20 0.41
BCL2 P10415 1/20 0.41
BECN1 Q14457 1/20 0.41
PTK6 Q13882 1/20 0.41
PPARG P37231 1/20 0.41
MAP4K4 O95819 1/20 0.40

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
SCHEMBL5889010 0.90 ALDH1A1 (0.44) MAPTTP53SMN1; SMN2ALDH1A1GAA
SCHEMBL17602102 0.85 ALDH1A1 (0.41) ALDH1A1GAAKMT2ACA12CA1
SCHEMBL2072185 0.85 ALDH1A1 (0.56) MAPTSMN1; SMN2ALDH1A1GAACA12
SCHEMBL31341992 0.85 ALDH1A1 (0.56) MAPTSMN1; SMN2ALDH1A1GAACA12
SCHEMBL4041975 0.84 GAA (0.60) TDP1MAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL17609095 0.84 ALDH1A1 (0.40) ALDH1A1GAACA12CA1CA9
SCHEMBL24073948 0.83 TDP1 (0.46) TDP1MAPTALDH1A1GAARORC
SCHEMBL6249473 0.83 TDP1 (0.53) TDP1MAPTSMN1; SMN2ALDH1A1GAA
SCHEMBL24072565 0.82 TDP1 (0.70) TDP1SMN1; SMN2ALDH1A1GAARORC
SCHEMBL9996831 0.81 MAPT (0.51) TDP1MAPTTP53SMN1; SMN2ALDH1A1

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-20050182040-A1 Benzamide derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2005-08-18 US disclosed
EP-1500643-A1 BENZAMIDE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-01-26 EP 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-20050182040-A1 Benzamide derivatives ROCK1, ROCK2, NHERF1 TDP1 3782/4885MAPT 4237/4885TP53 4611/4885

“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.