SCHEMBL6474636

SCHEMBL6474636

COC(=O)C1(NC(=O)C(Cl)c2ccccc2OC)CCC(C(C)C)CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 7/20 0.36
KCNA3 P22001 1/20 0.36
KCNK3 O14649 1/20 0.36
KCNK9 Q9NPC2 1/20 0.36
EPHX2 P34913 1/20 0.35
POLB P06746 1/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
P2RX7 Q99572 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
FAAH O00519 1/20 0.34
CNR2 P34972 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
SCHEMBL6475240 0.91 KCNK3 (0.38) LPAR1KCNA3KCNK3KCNK9EPHX2
SCHEMBL8906890 0.89 OPRL1 (0.39) EPHX2P2RX7MEN1KMT2A
SCHEMBL6483520 0.88 GAA (0.42) LPAR1EPHX2POLBHTTNPSR1
SCHEMBL6475780 0.87 KCNA3 (0.39) KCNA3EPHX2POLBHTTNPSR1
SCHEMBL6476219 0.86 ALDH1A1 (0.45) LPAR1POLBHTTNPSR1L3MBTL1
SCHEMBL6482572 0.85 MEN1 (0.39) KCNA3EPHX2POLBHTTNPSR1
SCHEMBL6482260 0.85 ALDH1A1 (0.37) KCNA3POLBHTTNPSR1L3MBTL1
SCHEMBL6484134 0.84 ALDH1A1 (0.46) LPAR1L3MBTL1MEN1KMT2AFAAH
SCHEMBL6474377 0.84 ALDH1A1 (0.46) LPAR1L3MBTL1MEN1KMT2AFAAH
SCHEMBL6482268 0.84 ALDH1A1 (0.46) LPAR1L3MBTL1MEN1KMT2AFAAH

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 1124/4885KCNA3 1788/4885KCNK3 774/4885

“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.