SCHEMBL2353393

SCHEMBL2353393

Cc1cc(F)c(Br)cc1C1=C(O)[C@]2(CC[C@@](O)(C(F)(F)F)CC2)NC1=O

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 11/20 0.48
▸ ACACA Q13085 11/20 0.48
▸ MKNK1 Q9BUB5 3/20 0.30

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
SCHEMBL14690166 1.00 ACACB (0.48) ACACBACACAMKNK1
SCHEMBL14700633 1.00 ACACB (0.48) ACACBACACAMKNK1
SCHEMBL14700640 0.92 ACACB (0.45) ACACBACACAMKNK1
SCHEMBL2351434 0.92 ACACB (0.45) ACACBACACAMKNK1
SCHEMBL14689760 0.92 ACACB (0.45) ACACBACACAMKNK1
SCHEMBL2353347 0.86 ACACB (0.45) ACACBACACA
SCHEMBL2354506 0.84 ACACB (0.45) ACACBACACA
SCHEMBL2354306 0.84 ACACB (0.64) ACACBACACA
SCHEMBL14700628 0.83 ACACB (0.54) ACACBACACAMKNK1
SCHEMBL2351690 0.83 ACACB (0.54) ACACBACACAMKNK1

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-20130040935-A1 CYCLIC KETO-ENOLS FOR THERAPY BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-02-14 — — US disclosed
EP-2536686-A1 CYCLIC KETO-ENOLS FOR THERAPY Bayer Intellectual Property GmbH (DE) 2012-12-26 — — EP disclosed
WO-2011098433-A1 CYCLIC KETO-ENOLS FOR THERAPY BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-08-18 — — WO 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-20130040935-A1 CYCLIC KETO-ENOLS FOR THERAPY AKR1B1, AKR1C3, AKR1A1 ACACB 310/4885ACACA 541/4885MKNK1 2085/4885

“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.

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