SCHEMBL867503

SCHEMBL867503

C=CC(C)(C)OC(=O)/C=C\C(=O)OC(C)(C)C=C

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.38
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL5679588 1.00 HCAR2 (0.38) HCAR2KEAP1NFE2L2ALDH1A1TP53
SCHEMBL5679594 0.91 HCAR2 (0.46) HCAR2KEAP1NFE2L2ALDH1A1TP53
SCHEMBL867504 0.91 HCAR2 (0.46) HCAR2KEAP1NFE2L2ALDH1A1TP53
SCHEMBL867505 0.91 HCAR2 (0.46) HCAR2KEAP1NFE2L2ALDH1A1TP53
SCHEMBL1345408 0.85 ALDH1A1 (0.40) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL4677471 0.83 ALDH1A1 (0.30) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL16668509 0.79 ALOX15 (0.35) ALDH1A1
SCHEMBL9541426 0.79
SCHEMBL10340440 0.79 ALDH1A1 (0.32) ALDH1A1
SCHEMBL1270028 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3131396-B1 PESTICIDAL TAPE FOR CONTROLLING CRAWLING PESTS BASF SE (DE) 2021-09-15 EP disclosed
US-10039281-B2 Pesticidal tape for controlling crawling pests BASF SE (DE) 2018-08-07 US disclosed
US-20170238538-A9 PESTICIDAL TAPE FOR CONTROLLING CRAWLING PESTS BASF SE (DE) 2017-08-24 US disclosed
US-20170035047-A1 PESTICIDAL TAPE FOR CONTROLLING CRAWLING PESTS BASF SE (DE) 2017-02-09 US disclosed
US-9464456-B2 System for protecting stored goods BASF SE (DE) 2016-10-11 US disclosed
EP-2723156-B1 SYSTEM FOR PROTECTING STORED GOODS BASF SE (DE) 2015-06-24 EP disclosed
US-20140190538-A1 System for Protecting Stored Goods BASF SE (DE) 2014-07-10 US disclosed
EP-2723156-A1 SYSTEM FOR PROTECTING STORED GOODS BASF SE (DE) 2014-04-30 EP disclosed
EP-2723611-A1 SYSTEM FOR PROTECTING GOODS DURING TRANSPORT BASF SE (DE) 2014-04-30 EP disclosed
WO-2013000907-A1 SYSTEM FOR PROTECTING GOODS DURING TRANSPORT BASF SE (DE) 2013-01-03 WO disclosed
WO-2013000906-A1 SYSTEM FOR PROTECTING STORED GOODS BASF SE (DE) 2013-01-03 WO disclosed
US-20120328685-A1 SYSTEM FOR PROTECTING GOODS DURING TRANSPORT BASF SE (DE) 2012-12-27 US disclosed
US-20120114726-A1 INSECTICIDE-COATED SUBSTRATE FOR PROTECTING HUMANS AND PETS BASF SE (DE) 2012-05-10 US disclosed
US-20120114727-A1 INSECTICIDAL SHEET-LIKE STRUCTURE FOR PROTECTING HUMANS AND DOMESTIC ANIMALS BASF SE (DE) 2012-05-10 US disclosed
US-20120079625-A1 Method for protecting living plants from harmful insects via a sheetlike structure BASF SE (DE) 2012-03-29 US disclosed
EP-0154270-B1 HYDROPHILIC POLYMERS AND CONTACT LENSES MADE THEREFROM Pilkington Visioncare, Inc. (a Delaware corp.) (US) 1990-08-08 EP 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-20170035047-A1 PESTICIDAL TAPE FOR CONTROLLING CRAWLING PESTS ACHE, AS3MT, DDT HCAR2 2830/4885KEAP1 2738/4885NFE2L2 4875/4885
US-20120114727-A1 INSECTICIDAL SHEET-LIKE STRUCTURE FOR PROTECTING HUMANS AND DOMESTIC ANIMALS L3MBTL4, L3MBTL3, L3MBTL1 HCAR2 3145/4885KEAP1 3456/4885NFE2L2 1914/4885
US-10039281-B2 Pesticidal tape for controlling crawling pests ACHE, AS3MT, DDT HCAR2 2830/4885KEAP1 2738/4885NFE2L2 4875/4885
US-20170238538-A9 PESTICIDAL TAPE FOR CONTROLLING CRAWLING PESTS ACHE, AS3MT, DDT HCAR2 2830/4885KEAP1 2738/4885NFE2L2 4875/4885
US-20120114726-A1 INSECTICIDE-COATED SUBSTRATE FOR PROTECTING HUMANS AND PETS DDT, PIR, CYP3A43 HCAR2 542/4885KEAP1 1310/4885NFE2L2 4383/4885

“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.