SCHEMBL6475221

SCHEMBL6475221

CCC(CC)(NC(=O)Cc1ccc(OC)cc1Cl)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
ALDH1A1 P00352 3/20 0.44
HTT P42858 2/20 0.44
THRB P10828 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CTSD P07339 1/20 0.43
CSNK1D P48730 1/20 0.43
P2RX7 Q99572 1/20 0.40
PLA2G2A P14555 3/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
RECQL P46063 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL6483829 0.90 MEN1 (0.44) MEN1KMT2AALDH1A1HTTTHRB
SCHEMBL7960768 0.87 MEN1 (0.46) MEN1KMT2AALDH1A1HTT
SCHEMBL6482516 0.85 SHMT1 (0.48) MEN1KMT2AALDH1A1HTTTHRB
SCHEMBL8654279 0.84 HPGD (0.39) KMT2AALDH1A1HTTL3MBTL1P2RX7
SCHEMBL4421064 0.82 MEN1 (0.42) MEN1KMT2AALDH1A1HTTTHRB
SCHEMBL4424507 0.80 MEN1 (0.41) MEN1KMT2AALDH1A1HTTTHRB
SCHEMBL6481408 0.80 GAA (0.46) MEN1KMT2AALDH1A1L3MBTL1CSNK1D
SCHEMBL6474981 0.80 MEN1 (0.46) MEN1KMT2AALDH1A1HTTTHRB
SCHEMBL4708186 0.78 MEN1 (0.51) MEN1KMT2AALDH1A1HTTTHRB
SCHEMBL4428397 0.77 MEN1 (0.42) MEN1KMT2AALDH1A1HTTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 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.