SCHEMBL879062

SCHEMBL879062

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

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACACB O00763 13/20 0.50
ACACA Q13085 13/20 0.50
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
THRB P10828 1/20 0.33
KMT2A Q03164 1/20 0.30
BACE1 P56817 1/20 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
SCHEMBL10328459 1.00 ACACB (0.50) ACACBACACACHRM2CHRM4CHRM5
SCHEMBL2850592 0.85 ACACB (0.52) ACACBACACACHRM2CHRM4CHRM5
SCHEMBL11932139 0.84 ACACB (0.52) ACACBACACACHRM2CHRM4CHRM5
SCHEMBL2850600 0.84 ACACB (0.54) ACACBACACACHRM2CHRM4CHRM5
SCHEMBL2850595 0.84 ACACB (0.54) ACACBACACACHRM2CHRM4CHRM5
SCHEMBL12778736 0.84 ACACB (0.52) ACACBACACACHRM2CHRM4CHRM5
SCHEMBL13527319 0.83 ACACB (0.51) ACACBACACACHRM2CHRM4CHRM5
SCHEMBL18393305 0.83 ACACB (0.51) ACACBACACACHRM2CHRM4CHRM5
SCHEMBL15894937 0.83 ACACB (0.51) ACACBACACACHRM2CHRM4CHRM5
SCHEMBL30057496 0.82 ACACB (0.70) ACACBACACACHRM2CHRM4CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3001905-B1 ACTIVE AGENT COMBINATIONS WITH INSECTICIDES AND ACARICIDE PROPERTIES BAYER IP GMBH (DE) 2017-11-01 EP disclosed
EP-2094080-B1 UTILISATION OF BLOCK COPOLYMERS BASED ON VINYL LACTAMES AND VINYL ACETATE AS SOLUBILISERS BASF SE (DE) 2017-06-07 EP disclosed
US-8211469-B2 Use of block copolymers based on vinyllactams and vinyl acetate as solubilizers BASF SE (DE) 2012-07-03 US disclosed
US-8143292-B2 N-Thio-anthranilamid compounds and their use as pesticides BASF SE (DE) 2012-03-27 US disclosed
US-7871960-B2 1-(Imidazolin-2-yl)amino-1,2-diphenylethane compounds for combating animal pests BASF SE (DE) 2011-01-18 US disclosed
US-20100062940-A1 Production of Solid Solutions of Pesticides by Short-Term Superheating and Rapid Drying BASF SE (DE) 2010-03-11 US disclosed
US-20100047203-A1 Use of Block Copolymers Based on Vinyllactams and Vinyl Acetate as Solubilizers BASF SE (DE) 2010-02-25 US disclosed
US-20100048661-A1 Active Compound Combinations Having Insecticidal and Acaricidal Properties BAYER CROPSCIENCE AG (DE) 2010-02-25 US disclosed
US-20090270259-A1 Novel Agrochemical Formulations BASF SE (DE) 2009-10-29 US disclosed
US-20080221168-A1 Methyl-phenyl-sulfamoyl-N-(5-bromo-2-(3-chloro-pyridin-2-yl)-2H-pyrazole-3-carboxylic acid (2-carbamoyl-6-methyl-phenyl))-amide BASF AKTIENGESELLSCHAFT (DE) 2008-09-11 US disclosed
US-20080207445-A1 Fast-Release Microcapsule Products BASF AKTIENGESELLSCHAFT (DE) 2008-08-28 US disclosed
US-20080200335-A1 1-(Imidazolin-2-Yl)Amino-1,2-Diphenylethane Compounds For Combating Animal Pests BASF AKTIENGESELLSCHAFT (DE) 2008-08-21 US disclosed
US-20080161403-A1 1-(1,2 Diphenyl-Ethyl)-3-(2-Hydroxyethyl)-Thiourea Compounds For Combating Animal Pests BASF AKTIENGESELLSCHAFT (DE) 2008-07-03 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 (8 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-20080221168-A1 Methyl-phenyl-sulfamoyl-N-(5-bromo-2-(3-chloro-pyridin-2-yl)-2H-pyrazole-3-carboxylic acid (2-carbamoyl-6-methyl-phenyl))-amide AADAC, AAAS, ACMSD ACACB 111/4885ACACA 18/4885CHRM2 46/4885
US-20100048661-A1 Active Compound Combinations Having Insecticidal and Acaricidal Properties ACAA2, CYP51A1, ACHE ACACB 7/4885ACACA 5/4885CHRM2 1341/4885
US-20080200335-A1 1-(Imidazolin-2-Yl)Amino-1,2-Diphenylethane Compounds For Combating Animal Pests ANXA1, ANXA11, AGO2 ACACB 3877/4885ACACA 3203/4885CHRM2 1111/4885
US-20100047203-A1 Use of Block Copolymers Based on Vinyllactams and Vinyl Acetate as Solubilizers VCL, MGAM, PBRM1 ACACB 467/4885ACACA 978/4885CHRM2 268/4885
US-20100062940-A1 Production of Solid Solutions of Pesticides by Short-Term Superheating and Rapid Drying ACHE, CS, STOM ACACB 287/4885ACACA 700/4885CHRM2 91/4885
US-20080161403-A1 1-(1,2 Diphenyl-Ethyl)-3-(2-Hydroxyethyl)-Thiourea Compounds For Combating Animal Pests H1-10, H1-3, H1-0 ACACB 4120/4885ACACA 3236/4885CHRM2 45/4885
US-20090270259-A1 Novel Agrochemical Formulations TACR1, NSF, ACHE ACACB 1253/4885ACACA 1715/4885CHRM2 267/4885
US-20080207445-A1 Fast-Release Microcapsule Products NSF, AUP1, SSRP1 ACACB 2436/4885ACACA 2633/4885CHRM2 2035/4885

“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.