SCHEMBL6474692

SCHEMBL6474692

CCC(C)C(NC(=O)C(Cl)c1ccccc1OC)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
KMT2A Q03164 4/20 0.44
MEN1 O00255 2/20 0.44
HTT P42858 2/20 0.44
POLB P06746 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ANPEP P15144 1/20 0.43
ALDH1A1 P00352 3/20 0.43
FPR2 P25090 2/20 0.42
ATM Q13315 1/20 0.42
MME P08473 1/20 0.41
ECE1 P42892 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CA2 P00918 1/20 0.41

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
SCHEMBL6476211 0.87 HPGD (0.48) KMT2AMEN1HTTPOLBL3MBTL1
SCHEMBL6481411 0.81 KMT2A (0.47) KMT2AHTTPOLBL3MBTL1NPSR1
SCHEMBL6474415 0.80 CYP2C9 (0.47) CYP2C9CYP2C19KMT2AMEN1ALDH1A1
SCHEMBL21274442 0.79 HPGD (0.60) CYP2C9CYP2C19KMT2AMEN1POLB
SCHEMBL3598204 0.79 HPGD (0.60) CYP2C9CYP2C19KMT2AMEN1POLB
SCHEMBL21274439 0.79 HPGD (0.60) CYP2C9CYP2C19KMT2AMEN1POLB
SCHEMBL27384186 0.79 ALDH1A1 (0.50) CYP2C9CYP2C19KMT2AMEN1HTT
SCHEMBL6474666 0.78 MME (0.52) HTTPOLBL3MBTL1NPSR1ANPEP
SCHEMBL27476382 0.77 KMT2A (0.48) CYP2C9CYP2C19KMT2AMEN1HTT
SCHEMBL8657309 0.76 ALDH1A1 (0.46) CYP2C9CYP2C19KMT2AMEN1L3MBTL1

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 CYP2C9 161/4885CYP2C19 428/4885KMT2A 2190/4885

“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.