SCHEMBL4421064

SCHEMBL4421064

CCCC(C)(NC(=O)Cc1ccc(OC)cc1Cl)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
ALDH1A1 P00352 2/20 0.42
HTT P42858 2/20 0.42
THRB P10828 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 1/20 0.39
CTSD P07339 1/20 0.39
P2RX7 Q99572 1/20 0.39
ANO1 Q5XXA6 1/20 0.39
CSNK1D P48730 1/20 0.39
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
PLA2G2A P14555 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
RECQL P46063 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
SCHEMBL4428397 0.91 MEN1 (0.42) MEN1KMT2AALDH1A1HTTTHRB
SCHEMBL6995171 0.88 MEN1 (0.43) MEN1KMT2AALDH1A1HTTANO1
SCHEMBL8557476 0.85 KMT2A (0.37) KMT2AALDH1A1HTTL3MBTL1KDM4E
SCHEMBL6482516 0.84 SHMT1 (0.48) MEN1KMT2AALDH1A1HTTTHRB
SCHEMBL6475221 0.82 MEN1 (0.44) MEN1KMT2AALDH1A1HTTTHRB
SCHEMBL4425144 0.81 GAA (0.44) MEN1KMT2AALDH1A1KDM4EANO1
SCHEMBL4424507 0.80 MEN1 (0.41) MEN1KMT2AALDH1A1HTTTHRB
SCHEMBL6474981 0.79 MEN1 (0.46) MEN1KMT2AALDH1A1HTTTHRB
SCHEMBL8552873 0.79 ALDH1A1 (0.38) MEN1KMT2AALDH1A1HTTTHRB
SCHEMBL6997846 0.79 MEN1 (0.41) MEN1KMT2AALDH1A1ANO1

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 MEN1 3194/4885KMT2A 2190/4885ALDH1A1 792/4885

“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.