SCHEMBL11025895

SCHEMBL11025895

COC1CCC2(CC1)NC(=O)C(c1ccc(Cl)cc1C)C2=O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACACB O00763 5/20 0.43
ACACA Q13085 5/20 0.43
DPP4 P27487 1/20 0.41
BACE1 P56817 12/20 0.38
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
APP P05067 2/20 0.33
TAAR1 Q96RJ0 1/20 0.33

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
SCHEMBL11028523 0.82 ACACB (0.39) ACACBACACADPP4BACE1SLC6A4
SCHEMBL2070159 0.82 ACACB (0.39) ACACBACACADPP4BACE1SLC6A4
SCHEMBL2072081 0.78 BACE1 (0.37) ACACBACACABACE1
SCHEMBL1941357 0.77 ACACB (0.48) ACACBACACADPP4BACE1APP
SCHEMBL1941359 0.77 ACACB (0.48) ACACBACACADPP4BACE1APP
SCHEMBL1344157 0.77 ACACB (0.39) ACACBACACADPP4BACE1SLC6A4
SCHEMBL1942867 0.76 ACACB (0.50) ACACBACACADPP4BACE1SLC6A4
SCHEMBL2525634 0.76 ACACB (0.37) ACACBACACADPP4BACE1SLC6A4
SCHEMBL8905942 0.76 GAA (0.42) DPP4
SCHEMBL1942308 0.76 ACACB (0.45) ACACBACACABACE1APP

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106905215-B Process for preparing 1-H-pyrrolidine-2, 4-dione derivatives 拜耳知识产权有限责任公司 2021-10-01 CN disclosed
EP-3372580-B1 METHOD FOR THE PREPARATION OF 1-H-PYRROLIDIN-2,4-DIONE-DERIVATIVES BAYER CROPSCIENCE AG (DE) 2020-07-22 EP disclosed
EP-3372580-A1 METHOD FOR THE PREPARATION OF 1-H-PYRROLIDIN-2,4-DIONE-DERIVATIVES Bayer CropScience Aktiengesellschaft (DE) 2018-09-12 EP disclosed
EP-2668158-B1 METHOD FOR PRODUCING 1-H-PYRROLIDINE-2,4-DIONE DERIVATIVES BAYER IP GMBH (DE) 2018-06-27 EP disclosed
US-8859782-B2 Process for the preparation of 1-H-pyrrolidine-2,4-dione derivatives BAYER CROPSCIENCE AG (DE) 2014-10-14 US disclosed
EP-2668158-A1 METHOD FOR PRODUCING 1-H-PYRROLIDINE-2,4-DIONE DERIVATIVES Bayer Intellectual Property GmbH (DE) 2013-12-04 EP disclosed
WO-2012101047-A1 METHOD FOR PRODUCING 1-H-PYRROLIDINE-2,4-DIONE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2012-08-02 WO disclosed
US-20120190865-A1 Process for the Preparation of 1-H-pyrrolidine-2,4-dione Derivatives BAYER CROPSCIENCE AG (DE) 2012-07-26 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-20120190865-A1 Process for the Preparation of 1-H-pyrrolidine-2,4-dione Derivatives DHPS, HPD, DOHH ACACB 4094/4885ACACA 4346/4885DPP4 912/4885

“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.