SCHEMBL6475240

SCHEMBL6475240

COc1ccccc1C(Cl)C(=O)NC1(C(=O)O)CCC(C(C)C)CC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 1/20 0.38
KCNK9 Q9NPC2 1/20 0.38
POLB P06746 2/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
LPAR1 Q92633 5/20 0.36
KCNA3 P22001 1/20 0.36
SLC6A9 P48067 1/20 0.35
EPHX2 P34913 1/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.34
P2RX7 Q99572 1/20 0.34

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
SCHEMBL6474636 0.91 LPAR1 (0.36) KCNK3KCNK9POLBHTTNPSR1
SCHEMBL6475347 0.88 GAA (0.42) POLBHTTNPSR1L3MBTL1LPAR1
SCHEMBL6474742 0.87 KCNA3 (0.39) POLBHTTNPSR1L3MBTL1KCNA3
SCHEMBL8907165 0.86 OPRL1 (0.40) LPAR1EPHX2KMT2AMEN1P2RX7
SCHEMBL6481628 0.86 ALDH1A1 (0.45) POLBHTTNPSR1L3MBTL1LPAR1
SCHEMBL6474098 0.85 MEN1 (0.39) POLBHTTNPSR1L3MBTL1SLC6A9
SCHEMBL6482529 0.85 POLB (0.39) POLBHTTNPSR1L3MBTL1LPAR1
SCHEMBL6475684 0.84 ALDH1A1 (0.46) L3MBTL1LPAR1KMT2AMEN1
SCHEMBL6485784 0.84 ALDH1A1 (0.46) L3MBTL1LPAR1KMT2AMEN1
SCHEMBL6485598 0.84 ALDH1A1 (0.46) L3MBTL1LPAR1KMT2AMEN1

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 KCNK3 774/4885KCNK9 1571/4885POLB 4505/4885

“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.