SCHEMBL6936062

SCHEMBL6936062

Cc1cc([O])cc(C)c1Cc1ccc(OCc2ccccc2)c(S(=O)(=O)c2ccc(F)cc2)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 3/20 0.40
NFE2L2 Q16236 3/20 0.40
AR P10275 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
LMNA P02545 4/20 0.38
HTT P42858 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 2/20 0.38
FFAR4 Q5NUL3 1/20 0.38
POLB P06746 1/20 0.38
STAT3 P40763 1/20 0.38
CYP19A1 P11511 2/20 0.37
ALDH1A1 P00352 1/20 0.37
PKM P14618 1/20 0.37
PPARA Q07869 2/20 0.37
PTGER1 P34995 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL6849586 0.92 OPRK1 (0.42) KEAP1NFE2L2ARMRGPRX4LMNA
SCHEMBL6856861 0.87 THRB (0.51) KEAP1NFE2L2FFAR4PPARA
SCHEMBL6852831 0.85 KEAP1 (0.36) KEAP1NFE2L2ARMRGPRX4LMNA
SCHEMBL6855496 0.83 CTRC (0.43) KEAP1NFE2L2MRGPRX4SMN1; SMN2FFAR4
SCHEMBL6855002 0.82 PPARA (0.43) KEAP1NFE2L2ARMRGPRX4FFAR4
SCHEMBL7089153 0.81 KEAP1 (0.46) KEAP1NFE2L2ARLMNAHTT
SCHEMBL6852995 0.80 KEAP1 (0.47) KEAP1NFE2L2ARLMNAHTT
SCHEMBL6849377 0.76 KEAP1 (0.40) KEAP1NFE2L2ARMRGPRX4LMNA
SCHEMBL6854181 0.75 MAOB (0.48) KEAP1NFE2L2ARLMNAHTT
SCHEMBL6852990 0.69 THRB (0.58) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1370523-A1 DIPHENYL DERIVATIVES Bayer Aktiengesellschaft (DE) 2003-12-17 EP disclosed
US-20030105078-A1 Diphenyl derivatives BAYER AKTIENGESSELLSCHAFT (DE) 2003-06-05 US disclosed
WO-2002072539-A1 DIPHENYL DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2002-09-19 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-20030105078-A1 Diphenyl derivatives DPP4, DPP3, DPM1 KEAP1 1863/4885NFE2L2 78/4885AR 1487/4885

“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.