SCHEMBL5771881

SCHEMBL5771881

Cc1ccc(Cl)c(C2C(=O)NC(C)C2=O)c1C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.33
HTR2C P28335 3/20 0.33
HTR2A P28223 2/20 0.33
HTR2B P41595 2/20 0.33
TP53 P04637 1/20 0.32
CES1 P23141 1/20 0.32
ALDH1A1 P00352 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PBRM1 Q86U86 2/20 0.31
CYP3A4 P08684 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
CASP1 P29466 1/20 0.30
KMT2A Q03164 1/20 0.30
HTR1A P08908 1/20 0.30
HTR1D P28221 1/20 0.30
HTR7 P34969 1/20 0.30
HTR5A P47898 1/20 0.30

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
SCHEMBL6308547 0.76 HTR2A (0.33) HTR2CHTR2AHTR2BPBRM1
SCHEMBL6838459 0.75 PBRM1 (0.39) MAPTHTR2CHTR2AHTR2BALDH1A1
SCHEMBL5488972 0.71 GAA (0.35) ALDH1A1NPSR1
SCHEMBL1813818 0.68 HTR2C (0.33) MAPTHTR2CHTR2AHTR2BALDH1A1
SCHEMBL1153007 0.68 MAP3K14 (0.35) MAPTHTR2CALDH1A1KDM4EMEN1
SCHEMBL9594833 0.67
SCHEMBL8650400 0.67 GAA (0.54) MAPTHTR2CHTR2AHTR2BTP53
SCHEMBL7098246 0.66 ALDH1A1 (0.38) MAPTALDH1A1NPSR1CYP3A4MEN1
SCHEMBL16592250 0.66 PARP15 (0.30)
SCHEMBL24112630 0.65 CES1 (0.47) MAPTHTR2CHTR2AHTR2BTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1721522-A2 Substituted phenylketo-enoles as biocides and herbicides Bayer CropScience AG (DE) 2006-11-15 EP disclosed
US-6486343-B1 Substituted phenyl keto enols as pesticides and herbicides BAYER AKTIENGESELLSCHAFT (DE) 2002-11-26 US disclosed
US-6388123-B1 MITICIDE, INSECTICIDE FOR PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2002-05-14 US disclosed
US-6271180-B2 INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-08-07 US disclosed
US-20010004629-A1 Substituted phenyl keto enols as pesticides and herbicides LIEB VOLKER (DE) 2001-06-21 US disclosed
US-6140358-A FOR CONTROLLING PESTS AND WEEDS BAYER AKTIENGESELLSCHAFT (DE) 2000-10-31 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-20010004629-A1 Substituted phenyl keto enols as pesticides and herbicides DDT, CYP4X1, CYP1B1 MAPT 4465/4885HTR2C 2525/4885HTR2A 3027/4885

“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.