SCHEMBL6474518

SCHEMBL6474518

COC(=O)C1(NC(=O)C(Cl)c2ccc(OC)cc2)CCC(C)CC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.39
HPGD P15428 2/20 0.38
OPRK1 P41145 1/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 3/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP2C19 P33261 1/20 0.36
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SMYD3 Q9H7B4 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL6475744 0.91 POLB (0.39) POLBHPGDKMT2AMEN1NPSR1
SCHEMBL6481442 0.89 SMYD3 (0.37) OPRK1KMT2ANPSR1ALDH1A1CYP3A4
SCHEMBL8652040 0.89 ADRA1D (0.35) ALDH1A1CYP3A4CYP2C19
SCHEMBL6474830 0.88 SMYD3 (0.36) OPRK1KMT2AMEN1NPSR1ALDH1A1
SCHEMBL6475580 0.88 MEN1 (0.41) KMT2AMEN1NPSR1
SCHEMBL6475209 0.87 KMT2A (0.36) KMT2AMEN1NPSR1ALDH1A1CYP3A4
SCHEMBL6480023 0.87 ALDH1A1 (0.35) OPRK1KMT2ANPSR1ALDH1A1CYP3A4
SCHEMBL6482178 0.87 NPSR1 (0.40) OPRK1KMT2AMEN1NPSR1ALDH1A1
SCHEMBL7950117 0.87 POLB (0.42) POLBHPGDOPRK1KMT2AMEN1
SCHEMBL6483593 0.86 MEN1 (0.43) KMT2AMEN1NPSR1ALDH1A1CYP3A4

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 POLB 4505/4885HPGD 985/4885OPRK1 1007/4885

“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.