SCHEMBL12733350

SCHEMBL12733350

CC(C)(C)c1ccc(Oc2ccc(Cl)cc2Br)cc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESRRA P11474 3/20 0.44
▸ NR1H4 Q96RI1 1/20 0.40
▸ SLC6A2 P23975 4/20 0.40
▸ SLC6A3 Q01959 2/20 0.40
▸ NR1I2 O75469 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ TTR P02766 1/20 0.40
▸ PGR P06401 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ ADORA3 P0DMS8 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HSPA5 P11021 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ CBR1 P16152 1/20 0.40
▸ TBXA2R P21731 1/20 0.40
▸ AGTR1 P30556 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ EPAS1 Q99814 3/20 0.37

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
SCHEMBL12732725 0.78 ESRRA (0.56) ESRRANR1H4SLC6A2SLC6A3NR1I2
SCHEMBL2789834 0.78 ALDH1A1 (0.54) NR1H4SLC6A2SLC6A3NR1I2LMNA
SCHEMBL12732798 0.77 ESRRA (0.45) ESRRANR1I2LMNAHSP90AA1MAPT
SCHEMBL12732576 0.75 ESRRA (0.50) ESRRANR1H4NR1I2LMNAHSP90AA1
SCHEMBL12733560 0.74 HSP90AA1 (0.51) ESRRANR1H4NR1I2LMNAHSP90AA1
SCHEMBL12732773 0.74 ESRRA (0.49) ESRRANR1I2LMNAHSP90AA1MAPT
SCHEMBL12732646 0.73 ALDH1A1 (0.50) ESRRANR1I2LMNAMAPTHPGD
SCHEMBL12732654 0.72 MEN1 (0.54) ESRRANR1I2LMNAMAPTALDH1A1
SCHEMBL12733352 0.72 ESRRA (0.53) ESRRANR1I2LMNAHSP90AA1MAPT
SCHEMBL12732749 0.72 HSP90AA1 (0.52) ESRRANR1I2LMNAHSP90AA1MAPT

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 4 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-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
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 2451/4885NR1H4 3997/4885SLC6A2 3495/4885

“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.

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