SCHEMBL17699504

SCHEMBL17699504

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

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL3342370 0.80 APP (0.35)
SCHEMBL19220237 0.78
SCHEMBL6570240 0.75
SCHEMBL27455553 0.74 APP (0.31)
SCHEMBL742679 0.73 USP2 (0.33)
SCHEMBL18906949 0.70 PTGS1 (0.31)
SCHEMBL19547658 0.69 THRB (0.33)
SCHEMBL6948923 0.66 BBOX1 (0.33)
Water SCHEMBL1913461 0.65 BBOX1 (0.32)
SCHEMBL15631777 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10450433-B2 Hydrophilic fluoroplastic substrates 3M INNOVATIVE PROPERTIES COMPANY (US) 2019-10-22 US disclosed
US-20180171089-A1 HYDROPHILIC FLUOROPLASTIC SUBSTRATES 3M INNOVATIVE PROPERTIES CO (US) 2018-06-21 US disclosed
US-9926420-B2 Hydrophilic fluoroplastic substrates 3M INNOVATIVE PROPERTIES COMPANY (US) 2018-03-27 US disclosed
US-20160115286-A1 HYDROPHILIC FLUOROPLASTIC SUBSTRATES 3M INNOVATIVE PROPERTIES COMPANY 2016-04-28 US disclosed