SCHEMBL6475742

SCHEMBL6475742

COc1ccc(CC(=O)NC2(C(=O)O)CCC(C)CC2)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
P2RX7 Q99572 2/20 0.42
ALDH1A1 P00352 2/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
FFAR4 Q5NUL3 1/20 0.39
GPR132 Q9UNW8 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
SHMT1 P34896 2/20 0.38
SHMT2 P34897 2/20 0.38
CTSD P07339 1/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
CSNK1D P48730 1/20 0.37
GAA P10253 2/20 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
SCHEMBL6474513 0.91 KMT2A (0.42) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL6483626 0.90 FFAR4 (0.43) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL6483794 0.90 MEN1 (0.42) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL6474818 0.89 MEN1 (0.41) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL6483531 0.89 SHMT1 (0.43) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL6482453 0.89 MEN1 (0.40) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL6475663 0.89 P2RX7 (0.42) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL7961954 0.88 ALDH1A1 (0.45) KMT2AMEN1P2RX7ALDH1A1GPR132
SCHEMBL6475226 0.88 MEN1 (0.45) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL6475252 0.88 MEN1 (0.45) KMT2AMEN1P2RX7ALDH1A1THRB

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 KMT2A 2190/4885MEN1 3194/4885P2RX7 898/4885

“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.