SCHEMBL6474513

SCHEMBL6474513

COC(=O)C1(NC(=O)Cc2ccc(OC)cc2Cl)CCC(C)CC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
P2RX7 Q99572 2/20 0.42
ALDH1A1 P00352 3/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
FFAR4 Q5NUL3 1/20 0.37
CSNK1D P48730 1/20 0.37
GAA P10253 2/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
SIGMAR1 Q99720 1/20 0.36
HTR1A P08908 1/20 0.36
SLC6A4 P31645 1/20 0.36
HPGD P15428 1/20 0.36
APOBEC3A P31941 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36

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
SCHEMBL6475742 0.91 KMT2A (0.42) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL6475206 0.90 MEN1 (0.42) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL6481439 0.90 MEN1 (0.42) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL6482176 0.89 KMT2A (0.41) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL8905510 0.89 TRPV1 (0.44) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL6475577 0.89 MEN1 (0.43) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL6480022 0.89 P2RX7 (0.42) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL6474825 0.89 MEN1 (0.40) KMT2AMEN1P2RX7ALDH1A1THRB
SCHEMBL8652037 0.88 P2RX7 (0.38) P2RX7THRBGAA
SCHEMBL7950115 0.88 ALDH1A1 (0.45) KMT2AMEN1P2RX7ALDH1A1GAA

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.