SCHEMBL6474520

SCHEMBL6474520

COc1ccccc1C(Cl)C(=O)NC1(C(=O)O)CCCC(C)C1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 1/20 0.40
ALDH1A1 P00352 2/20 0.37
GAA P10253 1/20 0.37
EPHX2 P34913 1/20 0.36
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
FAAH O00519 2/20 0.35
CNR2 P34972 1/20 0.35
HPGD P15428 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
SCHEMBL6483569 0.91 ALDH1A1 (0.37) ALDH1A1GAAEPHX2MEN1KMT2A
SCHEMBL8905912 0.87 MEN1 (0.36) GAAEPHX2MEN1KMT2A
SCHEMBL6475347 0.86 GAA (0.42) LPAR1ALDH1A1GAAEPHX2POLB
SCHEMBL6481628 0.86 ALDH1A1 (0.45) LPAR1ALDH1A1POLBHTTNPSR1
SCHEMBL6474841 0.86 LPAR1 (0.37) LPAR1GAAEPHX2POLBHTT
SCHEMBL6485598 0.85 ALDH1A1 (0.46) LPAR1ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL6475684 0.85 ALDH1A1 (0.46) LPAR1ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL6485784 0.85 ALDH1A1 (0.46) LPAR1ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL6482465 0.83 ALDH1A1 (0.36) LPAR1ALDH1A1POLBNPSR1FAAH
SCHEMBL6474742 0.81 KCNA3 (0.39) EPHX2POLBHTTNPSR1L3MBTL1

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 LPAR1 1124/4885ALDH1A1 792/4885GAA 1674/4885

“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.