SCHEMBL16343142

SCHEMBL16343142

C=C(C)C(=O)NCCC[N+](C)(C)CC.COS(=O)(=O)[O-]

nearest known ligand 0.41

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 3/20 0.41
KMT2A Q03164 2/20 0.32
ATM Q13315 1/20 0.32
CBLB Q13191 1/20 0.30
CYP3A4 P08684 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
GRK2 P25098 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL6117144 0.92 BBOX1 (0.36) BBOX1POLB
SCHEMBL2110268 0.90 BBOX1 (0.39) BBOX1KMT2AATM
SCHEMBL969702 0.89 BBOX1 (0.37) BBOX1
SCHEMBL6117441 0.88 TGFBR1 (0.30)
SCHEMBL153023 0.87 POLB (0.37) BBOX1POLB
SCHEMBL3764634 0.87 BBOX1 (0.43) BBOX1KMT2AATMCBLBMEN1
Hydrochloric Acid SCHEMBL6117375 0.85 BBOX1 (0.42) BBOX1KMT2AATMCBLBMEN1
Fluoride Ion SCHEMBL8583069 0.85 BBOX1 (0.42) BBOX1KMT2AATMCBLBMEN1
SCHEMBL6118217 0.83 POLB (0.36) BBOX1POLB
SCHEMBL4671317 0.81 POLB (0.38) BBOX1POLB

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-3016717-A1 AMPHOTERIC TER-POLYMERS FOR USE IN PERSONAL CARE COMPOSITIONS The Procter & Gamble Company (US) 2016-05-11 EP disclosed
US-20150011450-A1 Amphoteric Ter-Polymers For Use in Personal Care Compositions THE PROCTER & GAMBLE COMPANY 2015-01-08 US disclosed
WO-2015003035-A1 AMPHOTERIC TER-POLYMERS FOR USE IN PERSONAL CARE COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2015-01-08 WO 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-20150011450-A1 Amphoteric Ter-Polymers For Use in Personal Care Compositions C3AR1, H1-10, HRH3 BBOX1 3960/4885KMT2A 2178/4885ATM 2829/4885

“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.