SCHEMBL12732768

SCHEMBL12732768

CC(C)(C)c1ccc(Oc2cccc(Br)c2)cc1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESRRA P11474 3/20 0.42
▸ MAOB P27338 7/20 0.42
▸ ALDH1A1 P00352 4/20 0.39
▸ TSHR P16473 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ CYP1A2 P05177 2/20 0.38
▸ ALOX15 P16050 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ ATP2A2 P16615 1/20 0.38
▸ ATP2A3 Q93084 1/20 0.38
▸ MAOA P21397 2/20 0.38
▸ BCL2L1 Q07817 1/20 0.37
▸ MCL1 Q07820 1/20 0.37
▸ CYP2C9 P11712 2/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ ATM Q13315 1/20 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
SCHEMBL12732650 0.87 ESRRA (0.46) ESRRAALDH1A1TSHRTDP1CYP1A2
SCHEMBL12732773 0.85 ESRRA (0.49) ESRRAMAOBALDH1A1TSHRTDP1
SCHEMBL12732571 0.84 EGFR (0.40) ESRRAMAOBALDH1A1CYP1A2SMN1; SMN2
SCHEMBL12732623 0.83 LTA4H (0.53) ESRRAALDH1A1TSHRTDP1CYP1A2
SCHEMBL12732798 0.82 ESRRA (0.45) ESRRAALDH1A1TSHRTDP1CYP1A2
SCHEMBL12733352 0.80 ESRRA (0.53) ESRRAALDH1A1TSHRTDP1CYP1A2
SCHEMBL12732654 0.80 MEN1 (0.54) ESRRAALDH1A1TSHRTDP1CYP1A2
SCHEMBL12732749 0.80 HSP90AA1 (0.52) ESRRAALDH1A1TSHRTDP1CYP1A2
SCHEMBL12732554 0.79 CYP3A4 (0.45) ESRRAALDH1A1ALOX15SMN1; SMN2CYP2C9
SCHEMBL12732777 0.79 F10 (0.42) ESRRAALDH1A1TSHRTDP1MAPT

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 2451/4885MAOB 2906/4885ALDH1A1 2140/4885

“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.

Send feedback