SCHEMBL12658151

SCHEMBL12658151

C=CCc1c(C)cc(Cl)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.50
ALDH1A1 P00352 7/20 0.42
PPARG P37231 1/20 0.42
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42
CYP3A4 P08684 3/20 0.40
ALOX15 P16050 1/20 0.40
ALOX5 P09917 1/20 0.39
AR P10275 1/20 0.39
PTGS1 P23219 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
MAP3K14 Q99558 1/20 0.38
KDM4E B2RXH2 2/20 0.37
HPGD P15428 1/20 0.37
GAA P10253 1/20 0.37
ERN1 O75460 1/20 0.37
MAPT P10636 5/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36

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
SCHEMBL12858446 0.83 ERN1 (0.44) POLBALDH1A1MAP3K14KDM4EHPGD
SCHEMBL10754248 0.82 POLB (0.49) POLBALDH1A1PPARGPPARDPPARA
SCHEMBL10750885 0.78 POLB (0.45) POLBALDH1A1PPARGPPARDPPARA
SCHEMBL16401724 0.76 KDM4E (0.52) POLBALDH1A1PPARACYP3A4ALOX5
SCHEMBL16401877 0.75 GAA (0.42) POLBALDH1A1CYP3A4PTGS1KDM4E
SCHEMBL27123824 0.75 ATM (0.33) POLBKDM4EHPGDGAAERN1
SCHEMBL1153449 0.75 XDH (0.36) POLBALDH1A1PPARGPPARDCYP3A4
SCHEMBL14072696 0.72 POLB (0.53) POLBALDH1A1PPARGPPARDPPARA
SCHEMBL1931659 0.72 POLB (0.53) POLBALDH1A1PPARGPPARDPPARA
SCHEMBL9709272 0.71 ALDH1A1 (0.53) POLBALDH1A1PPARGPPARDPPARA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1606254-B1 2,4,6-PHENYL SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AG (DE) 2011-05-11 EP disclosed
US-20110092368-A1 2,4,6-Phenyl-substituted cyclic ketoenols FISCHER REINER 2011-04-21 US disclosed
US-20110092368-A1 2,4,6-Phenyl-substituted cyclic ketoenols FISCHER REINER 2011-04-21 US disclosed
US-7888285-B2 2,4,6-phenyl substituted cyclic ketoenols BAYER CROPSCIENCE AG (DE) 2011-02-15 US disclosed
US-7888285-B2 2,4,6-phenyl substituted cyclic ketoenols BAYER CROPSCIENCE AG (DE) 2011-02-15 US disclosed
US-20070015664-A1 2,4,6-Phenyl substituted cyclic ketoenols BAYER CROPSCIENCE AG (DE) 2007-01-18 US disclosed
US-20070015664-A1 2,4,6-Phenyl substituted cyclic ketoenols BAYER CROPSCIENCE AG (DE) 2007-01-18 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 (2 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-20070015664-A1 2,4,6-Phenyl substituted cyclic ketoenols CYP4X1, KDM4E, KCNE1 POLB 3973/4885ALDH1A1 2306/4885PPARG 580/4885
US-20110092368-A1 2,4,6-Phenyl-substituted cyclic ketoenols CYP4X1, KDM4E, PDHX POLB 3872/4885ALDH1A1 2227/4885PPARG 401/4885

“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.