SCHEMBL9924208

SCHEMBL9924208

CCC(O)CNC(Cc1cnc[nH]1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.53
ALDH1A1 P00352 3/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C19 P33261 1/20 0.53
ITGB2 P05107 3/20 0.52
ICAM1 P05362 3/20 0.52
ITGAL P20701 3/20 0.52
SLC7A5 Q01650 1/20 0.50
SLC6A5 Q9Y345 1/20 0.49
GGT1 P19440 1/20 0.47
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
SLC15A2 Q16348 1/20 0.45
CPB2 Q96IY4 1/20 0.44
REN P00797 1/20 0.44
EPHX2 P34913 1/20 0.43
GABRA1 P14867 1/20 0.42
TSHR P16473 1/20 0.42
NFKB1 P19838 1/20 0.42
GABRR1 P24046 1/20 0.42

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
SCHEMBL17861490 0.88 CYP3A4 (0.51) CYP3A4ALDH1A1CYP1A2CYP2C19ITGB2
SCHEMBL1666697 0.85 ALDH1A1 (0.58) CYP3A4ALDH1A1CYP1A2CYP2C19ITGB2
SCHEMBL11737075 0.80 CYP3A4 (0.48) CYP3A4ALDH1A1CYP1A2CYP2C19ITGB2
SCHEMBL11733015 0.80 CYP3A4 (0.48) CYP3A4ALDH1A1CYP1A2CYP2C19ITGB2
SCHEMBL10339074 0.79 SLC6A5 (0.60) CYP3A4ALDH1A1CYP1A2CYP2C19ITGB2
SCHEMBL151336 0.79 ITGB2 (0.60) CYP3A4ALDH1A1CYP1A2CYP2C19ITGB2
SCHEMBL29938832 0.79 ITGB2 (0.60) CYP3A4ALDH1A1CYP1A2CYP2C19ITGB2
SCHEMBL163397 0.79 ITGB2 (0.60) CYP3A4ALDH1A1CYP1A2CYP2C19ITGB2
SCHEMBL27043238 0.79 ITGB2 (0.60) CYP3A4ALDH1A1CYP1A2CYP2C19ITGB2
SCHEMBL18822346 0.78 ITGB2 (0.54) CYP3A4ALDH1A1CYP1A2CYP2C19ITGB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9204644-B2 Nanoparticles compositions containing polymers and anthranilic acid diamide insecticides for propagule coating E I DU PONT DE NEMOURS AND COMPANY (US) 2015-12-08 US disclosed
US-20150296781-A1 ACRYLATE/METHACRYLATE-BASED TRIBLOCK COPOLYMER/ANTHRANILIC DIAMIDE COMPOSITIONS FOR PROPAGULE COATING E. I. DUPONT DE NEMOURS AND COMPANY 2015-10-22 US disclosed
US-20140357483-A1 NANOPARTICLES COMPOSITIONS CONTAINING POLYMERS AND ANTHRANILIC ACID DIAMIDE INSECTICIDES FOR PROPAGULE COATING CORTEVA AGRISCIENCE LLC 2014-12-04 US disclosed
US-8575065-B2 Acrylate/methacrylate-based star copolymer/anthranilic diamide compositions for propagle coating E I DU PONT DE NEMOURS AND COMPANY (US) 2013-11-05 US disclosed
US-8569268-B2 Acrylate/methacrylate-based diblock copolymer/anthranilic diamide compositions for propagule coating E I DU PONT DE NEMOURS AND COMPANY (US) 2013-10-29 US disclosed
US-8563469-B2 Acrylate/methacrylate-based random copolymer/anthranilic diamide compositions for propagule coating E I DU PONT DE NEMOURS AND COMPANY (US) 2013-10-22 US disclosed
US-20120149563-A1 ACRYLATE/METHACRYLATE-BASED RANDOM COPOLYMER/ANTHRANILIC DIAMIDE COMPOSITIONS FOR PROPAGULE COATING E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-06-14 US disclosed
US-20120149566-A1 ACRYLATE/METHACRYLATE-BASED DIBLOCK COPOLYMER/ANTHRANILIC DIAMIDE COMPOSITIONS FOR PROPAGULE COATING E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-06-14 US disclosed
US-20120149567-A1 ACRYLATE/METHACRYLATE-BASED STAR COPOLYMER/ANTHRANILIC DIAMIDE COMPOSITIONS FOR PROPAGLE COATING E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-06-14 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 (5 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-20150296781-A1 ACRYLATE/METHACRYLATE-BASED TRIBLOCK COPOLYMER/ANTHRANILIC DIAMIDE COMPOSITIONS FOR PROPAGULE COATING DDT, MTDH, API5 CYP3A4 3377/4885ALDH1A1 911/4885CYP1A2 696/4885
US-20120149566-A1 ACRYLATE/METHACRYLATE-BASED DIBLOCK COPOLYMER/ANTHRANILIC DIAMIDE COMPOSITIONS FOR PROPAGULE COATING DDT, APMAP, MTDH CYP3A4 3533/4885ALDH1A1 836/4885CYP1A2 773/4885
US-20120149563-A1 ACRYLATE/METHACRYLATE-BASED RANDOM COPOLYMER/ANTHRANILIC DIAMIDE COMPOSITIONS FOR PROPAGULE COATING AGPS, THEM6, DDT CYP3A4 3508/4885ALDH1A1 1893/4885CYP1A2 1184/4885
US-20120149567-A1 ACRYLATE/METHACRYLATE-BASED STAR COPOLYMER/ANTHRANILIC DIAMIDE COMPOSITIONS FOR PROPAGLE COATING STAMBP, MTDH, AGPS CYP3A4 2467/4885ALDH1A1 2124/4885CYP1A2 674/4885
US-20140357483-A1 NANOPARTICLES COMPOSITIONS CONTAINING POLYMERS AND ANTHRANILIC ACID DIAMIDE INSECTICIDES FOR PROPAGULE COATING MTDH, DDT, AGPS CYP3A4 4457/4885ALDH1A1 503/4885CYP1A2 1932/4885

“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.