SCHEMBL7598654

SCHEMBL7598654

CC(C)(CN)Oc1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.55
PPARG P37231 4/20 0.55
PPARA Q07869 3/20 0.51
FABP2 P12104 1/20 0.49
SLC22A12 Q96S37 1/20 0.49
STS P08842 1/20 0.49
GAA P10253 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46

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
SCHEMBL23544180 0.85 ELANE (0.57) ELANEPPARGPPARAFABP2SLC22A12
SCHEMBL23369295 0.83 PPARG (0.43) ELANEPPARGPPARAFABP2SLC22A12
SCHEMBL23899116 0.83 ELANE (0.54) ELANEPPARGPPARAFABP2SLC22A12
SCHEMBL19156186 0.83 ELANE (0.54) ELANEPPARGPPARAFABP2SLC22A12
SCHEMBL5281549 0.81 ELANE (0.64) ELANEPPARGPPARAFABP2SLC22A12
SCHEMBL5675865 0.80 TAAR1 (0.46) PPARGALDH1A1SMN1; SMN2
SCHEMBL19775908 0.80 ELANE (0.51) ELANEPPARGPPARAFABP2SLC22A12
SCHEMBL23369348 0.80 PPARG (0.40) ELANEPPARGPPARAFABP2SLC22A12
SCHEMBL9451181 0.79 CYP19A1 (0.62) MAPT
SCHEMBL5156847 0.79 CA1 (0.55) STSL3MBTL1ALDH1A1SMN1; SMN2MAPT

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-20020161007-A1 Non-steroidal modulators of estrogen receptors PROVOST, FELLOWS AND SCHOLARS OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN (IE) 2002-10-31 US disclosed
WO-2002066415-A2 NON-STEROIDAL MODULATORS OF ESTROGEN RECEPTORS THE PROVOST, FELLOWS AND SCHOLARS OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH NEAR DUBLIN (IE) 2002-08-29 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-20020161007-A1 Non-steroidal modulators of estrogen receptors ESRRB, ESR2, ESRRG ELANE 1218/4885PPARG 115/4885PPARA 211/4885

“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.