SCHEMBL12733352

SCHEMBL12733352

CC(C)(C)c1ccc(Oc2ccc(O)c(O)c2)cc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 6/20 0.53
ALDH1A1 P00352 6/20 0.48
ALOX15 P16050 4/20 0.48
HSD17B10 Q99714 2/20 0.48
LMNA P02545 2/20 0.48
NR1I2 O75469 1/20 0.48
CYP2C9 P11712 1/20 0.48
MIF P14174 1/20 0.48
TYR P14679 1/20 0.48
HTT P42858 1/20 0.48
NFE2L2 Q16236 1/20 0.48
KDM4E B2RXH2 1/20 0.46
CYP1A2 P05177 1/20 0.46
MAPT P10636 1/20 0.46
ATP2A2 P16615 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ATP2A3 Q93084 1/20 0.46
TDP1 Q9NUW8 2/20 0.45
HPGD P15428 2/20 0.45
GAA P10253 1/20 0.44

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
SCHEMBL12732749 0.89 HSP90AA1 (0.52) ESRRAALDH1A1ALOX15HSD17B10LMNA
SCHEMBL12732654 0.89 MEN1 (0.54) ESRRAALDH1A1ALOX15HSD17B10LMNA
SCHEMBL12733323 0.87 ESRRA (0.51) ESRRAALDH1A1ALOX15HSD17B10LMNA
SCHEMBL15511820 0.86 ESRRA (0.55) ESRRAALDH1A1ALOX15HSD17B10LMNA
SCHEMBL12732739 0.86 ESRRA (0.48) ESRRAALDH1A1ALOX15HSD17B10LMNA
SCHEMBL12733294 0.86 ESRRA (0.48) ESRRAALDH1A1ALOX15HSD17B10LMNA
SCHEMBL12732640 0.85 LTA4H (0.57) ESRRAALDH1A1ALOX15HSD17B10LMNA
SCHEMBL12732623 0.85 LTA4H (0.53) ESRRAALDH1A1ALOX15HSD17B10LMNA
SCHEMBL12732650 0.85 ESRRA (0.46) ESRRAALDH1A1ALOX15HSD17B10LMNA
SCHEMBL12733577 0.84 ESRRA (0.54) ESRRAALDH1A1ALOX15HSD17B10LMNA

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-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 ESRRA 2451/4885ALDH1A1 2140/4885ALOX15 4338/4885

“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.