SCHEMBL4546182

SCHEMBL4546182

Cc1cc(-c2ccc(Cl)cc2)cc(C)c1C1=C(OC(=O)C(C)(C)C)C(C)(CCO)NC1=O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACACB O00763 5/20 0.35
ACACA Q13085 5/20 0.35
ELANE P08246 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL10278965 0.90 ACACB (0.41) ACACBACACAELANEL3MBTL1NPC1
SCHEMBL4546186 0.80 ACACB (0.42) ACACBACACA
SCHEMBL4546188 0.78 ACACB (0.33) ACACBACACARAB9ATDP1
SCHEMBL2759799 0.76 ACACB (0.41) ACACBACACAELANE
SCHEMBL4546191 0.76 ACACB (0.41) ACACBACACA
SCHEMBL12136938 0.75 ELANE (0.33) ELANEL3MBTL1
SCHEMBL4549944 0.74 ACACB (0.35) ACACBACACARAB9A
SCHEMBL811909 0.74 ACACB (0.38) ACACBACACARAB9A
SCHEMBL4546187 0.73 ACACB (0.39) ACACBACACA
SCHEMBL4546185 0.73 ACACB (0.50) ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8173697-B2 Alkoxyalkyl-substituted cyclic keto-enols BAYER CROPSCIENCE AG (DE) 2012-05-08 US disclosed
US-20090298828-A1 Alkoxyalkyl-Substituted Cyclic Keto-Enols BAYER CROPSCIENCE AG (DE) 2009-12-03 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-20090298828-A1 Alkoxyalkyl-Substituted Cyclic Keto-Enols DDT, AKR1D1, EBP ACACB 249/4885ACACA 529/4885ELANE 3089/4885

“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.