SCHEMBL1670511

SCHEMBL1670511

CC(C)(C)OC(=O)NS(=O)(=O)NCc1cccc(Oc2cc(F)c(F)c(F)c2C(=O)O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.56
CA14 Q9ULX7 2/20 0.56
CA1 P00915 1/20 0.56
CA7 P43166 1/20 0.56
CA2 P00918 5/20 0.44
MAP2K1 Q02750 5/20 0.44
SCN9A Q15858 3/20 0.38
PPARG P37231 2/20 0.34
PPARD Q03181 2/20 0.34
PPARA Q07869 2/20 0.34
ALDH1A1 P00352 2/20 0.34
KCNQ3 O43525 1/20 0.34
KCNQ2 O43526 1/20 0.34
JAK2 O60674 1/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
ATM Q13315 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL12801863 0.86 CA12 (0.61) CA12CA14CA1CA7CA2
SCHEMBL1670588 0.85 MAP2K1 (0.65) CA12CA14CA1CA7CA2
SCHEMBL12805162 0.80 MAP2K1 (0.75) CA1CA2MAP2K1
SCHEMBL6337412 0.74 CA12 (1.00) CA12CA14CA1CA7CA2
SCHEMBL12710072 0.74 MAP2K1 (0.62) CA12CA14CA1CA7CA2
SCHEMBL12710128 0.73 CA12 (0.74) CA12CA14CA1CA7CA2
SCHEMBL12002435 0.73 CA2 (0.42) CA12CA14CA1CA7CA2
SCHEMBL12710203 0.71 MAP2K1 (0.54) CA12CA14CA1CA7CA2
SCHEMBL12709649 0.71 MAP2K1 (0.56) CA12CA14CA1CA7CA2
SCHEMBL2473675 0.69 CA12 (0.66) CA12CA14CA1CA7CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120263714-A1 SUBSTITUTED HALOPHENOXYBENZAMIDE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-10-18 US disclosed
US-20120263714-A1 SUBSTITUTED HALOPHENOXYBENZAMIDE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-10-18 US disclosed
US-20120263714-A1 SUBSTITUTED HALOPHENOXYBENZAMIDE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-10-18 US disclosed
EP-2491014-A1 SUBSTITUTED HALOPHENOXYBENZAMIDE DERIVATIVES Bayer Pharma Aktiengesellschaft (DE) 2012-08-29 EP disclosed
WO-2011047796-A1 SUBSTITUTED HALOPHENOXYBENZAMIDE DERIVATIVES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-04-28 WO disclosed
WO-2011047796-A1 SUBSTITUTED HALOPHENOXYBENZAMIDE DERIVATIVES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-04-28 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-20120263714-A1 SUBSTITUTED HALOPHENOXYBENZAMIDE DERIVATIVES RB1, HRH4, VEGFA CA12 2359/4885CA14 3021/4885CA1 4092/4885

“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.