SCHEMBL4426474

SCHEMBL4426474

COc1cc(Cl)ccc1C1C(=O)NC(C)(CC(C)C)C1=O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 4/20 0.46
ADAMTS5 Q9UNA0 3/20 0.46
CA2 P00918 2/20 0.35
LPAR1 Q92633 4/20 0.35
LMNA P02545 1/20 0.33
CDYL2 Q8N8U2 1/20 0.33
CDYL Q9Y232 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
TRPV4 Q9HBA0 1/20 0.33
FDFT1 P37268 1/20 0.32

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
SCHEMBL6986616 0.87 CA2 (0.36) ADAM17ADAMTS5CA2LPAR1LMNA
SCHEMBL8558103 0.84 MDM2 (0.33) ADAM17ADAMTS5LMNAGAA
SCHEMBL4433853 0.79 ADAM17 (0.39) ADAM17ADAMTS5CA2LPAR1LMNA
SCHEMBL8862627 0.74 ALDH1A1 (0.33) ADAM17ADAMTS5LMNAALDH1A1GAA
SCHEMBL2676263 0.67 ACACB (0.36)
SCHEMBL4433341 0.67 GAA (0.40) ADAM17ADAMTS5CA2LPAR1CDYL2
SCHEMBL6997566 0.67 CA2 (0.37) CA2ALDH1A1GAA
SCHEMBL2677397 0.67 ACACB (0.41)
SCHEMBL7769009 0.66 GAA (0.42) LMNAALDH1A1GAA
SCHEMBL8555344 0.64 CACNB4 (0.38) LMNAGAA

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-0741700-B1 1-H-3-ARYLPYRROLIDINE-2,4-DIONE DERIVATIVES AS PEST-CONTROL AGENTS BAYER CROPSCIENCE AG (DE) 2009-10-07 EP disclosed
US-6939888-B2 1-H-3-arylpirrolidine-2,4-dione derivatives BAYER AKTIENGESELLSCHAFT (DE) 2005-09-06 US disclosed
US-20040019061-A1 1-H-3-arylpirrolidine-2,4-dione derivatives FISCHER REINER (DE) 2004-01-29 US disclosed
US-6472419-B1 1-H-3-aryl-pyrrolidine-2, 4-dione derivatives as pest-control agents BAYER AKTIENGESELLSCHAFT (DE) 2002-10-29 US disclosed
EP-0741700-A1 1-H-3-ARYLPYRROLIDINE-2,4-DIONE DERIVATIVES AS PEST-CONTROL AGENTS BAYER AG (DE) 1996-11-13 EP disclosed
WO-1995020572-A1 1-H-3-ARYLPYRROLIDINE-2,4-DIONE DERIVATIVES AS PEST-CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1995-08-03 WO 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-20040019061-A1 1-H-3-arylpirrolidine-2,4-dione derivatives PRXL2A, DDT, CYP4B1 ADAM17 2903/4885ADAMTS5 4249/4885CA2 2877/4885

“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.