SCHEMBL5162456

SCHEMBL5162456

C=C(C)COCC[N+](C)(C)CCCS(=O)(=O)O

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 1/20 0.35

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
Water SCHEMBL22773556 0.98 BBOX1 (0.34) BBOX1
Water SCHEMBL5161722 0.98 BBOX1 (0.34) BBOX1
Betaine SCHEMBL7991073 0.89 TSHR (0.35)
SCHEMBL4056939 0.86 BBOX1 (0.53) BBOX1
SCHEMBL973803 0.81 APP (0.37)
SCHEMBL7770974 0.80 CES2 (0.37)
SCHEMBL16788554 0.79 BBOX1 (0.38) BBOX1
SCHEMBL15830120 0.79 THRB (0.46)
SCHEMBL15339871 0.78 APP (0.33) BBOX1
Water SCHEMBL7896367 0.77 THRB (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1414867-B1 POLYMERS AND THEIR SYNTHESIS UNILEVER PLC (GB) 2007-03-14 EP claimed
EP-1409629-B1 USE OF GRAFT POLYMERS IN FABRIC CLEANING UNILEVER PLC (GB) 2005-10-19 EP claimed
US-20030161804-A1 Self-adhesive cationic or amphoteric free-radical polymers and cosmetic use thereof L'OREAL (FR) 2003-08-28 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 (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-20030161804-A1 Self-adhesive cationic or amphoteric free-radical polymers and cosmetic use thereof PARN, PCNA, F13A1 BBOX1 1493/4885

“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.