SCHEMBL4433880

SCHEMBL4433880

COC(=O)[C@H](C)NC(=O)Cc1c(Cl)cccc1OC

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.46
THRB P10828 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
PTGS2 P35354 2/20 0.44
RECQL P46063 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
LPAR1 Q92633 1/20 0.43
HTT P42858 1/20 0.42
POLB P06746 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL6475048 1.00 ALDH1A1 (0.47) ALDH1A1LMNATHRBSMN1; SMN2PTGS2
SCHEMBL4431529 0.90 SHMT2 (0.51) ALDH1A1LMNATHRBSMN1; SMN2MEN1
SCHEMBL4431531 0.90 SHMT2 (0.51) ALDH1A1LMNATHRBSMN1; SMN2MEN1
SCHEMBL4421840 0.87 ALDH1A1 (0.50) ALDH1A1LMNATHRBSMN1; SMN2MEN1
SCHEMBL6482103 0.87 ALDH1A1 (0.50) ALDH1A1LMNATHRBSMN1; SMN2MEN1
SCHEMBL6475199 0.85 NOS3 (0.51) ALDH1A1LMNATHRB
SCHEMBL4426485 0.85 NOS3 (0.51) ALDH1A1LMNATHRB
SCHEMBL4425138 0.84 ALDH1A1 (0.53) ALDH1A1LMNATHRBSMN1; SMN2HTT
SCHEMBL6481137 0.84 ALDH1A1 (0.53) ALDH1A1LMNATHRBSMN1; SMN2HTT
SCHEMBL4435142 0.82 MBTPS1 (0.47) ALDH1A1LMNATHRBSMN1; SMN2MEN1

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
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

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 ALDH1A1 792/4885LMNA 2427/4885THRB 1717/4885

“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.