SCHEMBL11941310

SCHEMBL11941310

Cc1ccc(C)c(C2=C(O)C3(CCC(C)CC3)NC2=O)c1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACACB O00763 11/20 0.56
ACACA Q13085 11/20 0.56
THRB P10828 1/20 0.46
FPR2 P25090 1/20 0.38
MAPT P10636 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
WEE1 P30291 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
SCHEMBL16490009 1.00 ACACB (0.56) ACACBACACATHRBFPR2MAPT
SCHEMBL14704798 0.90 ACACB (0.56) ACACBACACATHRBCA1CA2
SCHEMBL12458437 0.89 ACACB (0.53) ACACBACACATHRBFPR2
SCHEMBL14689609 0.89 ACACB (0.53) ACACBACACATHRBFPR2
SCHEMBL14689611 0.89 ACACB (0.53) ACACBACACATHRBFPR2
SCHEMBL14432172 0.87 ACACB (0.50) ACACBACACATHRBFPR2
SCHEMBL12841315 0.86 ACACB (0.59) ACACBACACATHRBMAPTCA1
SCHEMBL13596570 0.86 ACACB (0.59) ACACBACACATHRBCA1CA2
SCHEMBL30057496 0.86 ACACB (0.70) ACACBACACATHRBCA1CA2
SCHEMBL13174171 0.86 ACACB (0.59) ACACBACACATHRBMAPTCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170000143-A1 A METHOD OF INDUCING RIPENESS IN FRUIT BAYER CROPSCIENCE AG (DE) 2017-01-05 US disclosed
US-9272997-B2 Process for the preparation of 1-H-pyrrolidine-2,4-dione derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-03-01 US disclosed
US-20140371468-A1 Process for the Preparation of 1-H-pyrrolidine-2,4-dione Derivatives BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2014-12-18 US 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
US-20120190865-A1 Process for the Preparation of 1-H-pyrrolidine-2,4-dione Derivatives BAYER CROPSCIENCE AG (DE) 2012-07-26 US disclosed
EP-1277734-B1 2- and 2,5-substituted phenylketo-enols BAYER CROPSCIENCE AG (DE) 2007-02-07 EP 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 (2 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 4346/4885THRB 4427/4885
US-20140371468-A1 Process for the Preparation of 1-H-pyrrolidine-2,4-dione Derivatives DHPS, HPD, DOHH ACACB 4094/4885ACACA 4346/4885THRB 4427/4885

“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.