SCHEMBL4637540

SCHEMBL4637540

C=CCC(C(=O)[O-])(C(=O)C=C)[N+](C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 2/20 0.36

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
SCHEMBL87614 0.83 BBOX1 (0.37) BBOX1
SCHEMBL4638286 0.79 BBOX1 (0.34) BBOX1
SCHEMBL2901380 0.73 BBOX1 (0.32) BBOX1
Pyridine SCHEMBL9241200 0.73 ALDH1A1 (0.34) BBOX1
SCHEMBL15553114 0.71 BBOX1 (0.39) BBOX1
SCHEMBL1075301 0.69 BBOX1 (0.38) BBOX1
SCHEMBL8584513 0.69 BBOX1 (0.38) BBOX1
SCHEMBL9275326 0.68 BBOX1 (0.37) BBOX1
SCHEMBL2126303 0.67 BBOX1 (0.36) BBOX1
SCHEMBL5134436 0.66 BBOX1 (0.35) BBOX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101203271-A Product release system to atomize polymer-containing cosmetic hair compositions PROCTER & GAMBLE (US) 2008-06-18 CN claimed
US-20080112898-A1 Product release system to atomize polymer-containing cosmetic hair compositions PROCTER & GAMBLE COMPANY, THE 2008-05-15 US claimed
EP-1896137-A1 PRODUCT RELEASE SYSTEM TO ATOMIZE POLYMER-CONTAINING COSMETIC HAIR COMPOSITIONS Wella Aktiengesellschaft (DE) 2008-03-12 EP claimed
WO-2007002045-A1 PRODUCT RELEASE SYSTEM TO ATOMIZE POLYMER-CONTAINING COSMETIC HAIR COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2007-01-04 WO claimed
CN-104042453-B Cosmetic composition 科思创聚合物(中国)有限公司 2018-07-06 CN disclosed
CN-105380823-A Aqueous nail polish composition BAYER MAT TECH (CHINA) CO LTD 2016-03-09 CN 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-20080112898-A1 Product release system to atomize polymer-containing cosmetic hair compositions CUTA, SUCLG1, POLR1C BBOX1 4721/4885

“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.