SCHEMBL2850600

SCHEMBL2850600

COC1CCC2(CC1)NC(=O)C(c1cc(C)ccc1C)=C2OC(=O)O

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACACB O00763 13/20 0.54
ACACA Q13085 13/20 0.54
THRB P10828 1/20 0.34
CHRM2 P08172 2/20 0.33
CHRM4 P08173 2/20 0.33
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
ABL1 P00519 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
SCHEMBL2850595 1.00 ACACB (0.54) ACACBACACATHRBCHRM2CHRM4
SCHEMBL2850592 0.93 ACACB (0.52) ACACBACACATHRBCHRM2CHRM4
SCHEMBL12778736 0.92 ACACB (0.52) ACACBACACATHRBCHRM2CHRM4
SCHEMBL11932139 0.92 ACACB (0.52) ACACBACACATHRBCHRM2CHRM4
SCHEMBL15894937 0.91 ACACB (0.51) ACACBACACATHRBCHRM2CHRM4
SCHEMBL18393305 0.91 ACACB (0.51) ACACBACACATHRBCHRM2CHRM4
SCHEMBL13527319 0.91 ACACB (0.51) ACACBACACATHRBCHRM2CHRM4
Spirotetramat SCHEMBL14855635 0.89 ACACB (0.49) ACACBACACATHRBMEN1KMT2A
Spirotetramat SCHEMBL337030 0.89 ACACB (0.49) ACACBACACATHRBMEN1KMT2A
SCHEMBL12778707 0.89 ACACB (0.49) ACACBACACATHRBCHRM2CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2114118-B1 SAFEGUARDING SEED SAFETY OF TREATED SEEDS BAYER CROPSCIENCE AG (DE) 2012-09-12 EP claimed
US-20100130365-A1 SAFEGUARDING SEED SAFETY OF TREATED SEEDS BAYER CROPSCIENCE AG (DE) 2010-05-27 US claimed
EP-2094080-B1 UTILISATION OF BLOCK COPOLYMERS BASED ON VINYL LACTAMES AND VINYL ACETATE AS SOLUBILISERS BASF SE (DE) 2017-06-07 EP disclosed
EP-2114118-B2 SAFEGUARDING SEED SAFETY OF TREATED SEEDS BAYER CROPSCIENCE AG (DE) 2016-12-14 EP disclosed
US-9049813-B2 Safeguarding seed safety of treated seeds BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-06-09 US disclosed
EP-2114118-B1 SAFEGUARDING SEED SAFETY OF TREATED SEEDS BAYER CROPSCIENCE AG (DE) 2012-09-12 EP disclosed
EP-2001295-B1 ACTIVE INGREDIENT COMBINATIONS WITH INSECTICIDAL AND ACARICIDAL PROPERTIES BAYER CROPSCIENCE AG (DE) 2011-08-03 EP disclosed
US-20100130365-A1 SAFEGUARDING SEED SAFETY OF TREATED SEEDS BAYER CROPSCIENCE AG (DE) 2010-05-27 US disclosed
EP-1915344-B1 CYANOPYRIDINE PESTICIDES BASF SE (DE) 2009-07-01 EP disclosed
WO-2007014913-A1 CYANOPYRIDINE PESTICIDES BASF AKTIENGESELLSCHAFT (DE) 2007-02-08 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-20100130365-A1 SAFEGUARDING SEED SAFETY OF TREATED SEEDS TUBA3C, TUBB3, TUBA1C ACACB 98/4885ACACA 145/4885THRB 4865/4885

“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.