SCHEMBL12733320

SCHEMBL12733320

CC(C)(C)c1ccc(Cc2ccc(O)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.73
TYR P14679 1/20 0.73
ESR1 P03372 9/20 0.64
ESR2 Q92731 8/20 0.64
ESRRG P62508 6/20 0.54
ESRRB O95718 2/20 0.53
CYP3A4 P08684 2/20 0.52
AR P10275 1/20 0.52
HPGD P15428 1/20 0.52
TSHR P16473 1/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A4 P31645 1/20 0.52
HTR6 P50406 1/20 0.52
SLC6A3 Q01959 1/20 0.52
HSD17B10 Q99714 1/20 0.52
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
HSP90AA1 P07900 1/20 0.49
HSP90AB1 P08238 1/20 0.49
SHBG P04278 1/20 0.48

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
SCHEMBL348623 0.88 TSHR (0.52) LMNATYRTSHRALDH1A1
SCHEMBL3649608 0.86 MEN1 (0.66) LMNATYRESR1ESR2ESRRG
SCHEMBL7942894 0.86 ESR1 (0.73) LMNATYRESR1ESR2ESRRG
Bisphenol A SCHEMBL5291081 0.86 ESR1 (0.73) LMNATYRESR1ESR2ESRRG
SCHEMBL9106331 0.85 ESR1 (0.56) LMNATYRESR1ESR2ESRRG
SCHEMBL19157 0.85 LMNA (1.00) LMNATYRESR1ESR2ESRRG
Propane SCHEMBL2158324 0.83 LMNA (0.84) LMNATYRESR1ESR2ESRRG
Hydrochloric Acid SCHEMBL6851208 0.83 LMNA (0.94) LMNATYRESR1ESR2ESRRG
Hydrogen Sulfide SCHEMBL1975873 0.83 LMNA (0.94) LMNATYRESR1ESR2ESRRG
Hydrogen Sulfide SCHEMBL20597835 0.83 LMNA (0.94) LMNATYRESR1ESR2ESRRG

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
CN-113412306-A Polyarylate resin composition and molded article using the same 尤尼吉可株式会社 2021-09-17 CN disclosed
US-7932283-B2 Fungicide N-cyclopropyl-sulfonylamide derivatives BAYER CROPSCIENCE AG (DE) 2011-04-26 US disclosed
US-20090137611-A1 Fungicide N-Cyclopropyl-Sulfonylamide Derivatives BAYER CROPSCIENCE AG (DE) 2009-05-28 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-20090137611-A1 Fungicide N-Cyclopropyl-Sulfonylamide Derivatives CYP51A1, ERG28, CBR3 LMNA 3073/4885TYR 1337/4885ESR1 4253/4885

“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.