SCHEMBL12852736

SCHEMBL12852736

CCCC[N+](C)(C)CCC(C)(C)NCl

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 8/20 0.46
HTT P42858 2/20 0.43
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
GRK2 P25098 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HSP90AA1 P07900 2/20 0.36
RAD52 P43351 2/20 0.36
PLA2G1B P04054 1/20 0.36
ATG4B Q9Y4P1 1/20 0.36
SLC22A1 O15245 1/20 0.32

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
Hydrochloric Acid SCHEMBL3248335 0.98 DNM1 (0.45) DNM1HTTKMT2ALMNAMEN1
SCHEMBL12852754 0.92 HTT (0.56) DNM1HTTKMT2ALMNAMEN1
SCHEMBL12852752 0.92 HTT (0.56) DNM1HTTKMT2ALMNAMEN1
SCHEMBL13355844 0.92 HTT (0.56) DNM1HTTKMT2ALMNAMEN1
Hydrochloric Acid SCHEMBL3244405 0.91 HTT (0.54) DNM1HTTKMT2ALMNAHSP90AA1
Hydrochloric Acid SCHEMBL3250369 0.91 HTT (0.54) DNM1HTTKMT2ALMNAHSP90AA1
SCHEMBL17030355 0.88 DNM1 (0.38) DNM1HTT
SCHEMBL12852565 0.84 DNM1 (0.32) DNM1SLC22A1
SCHEMBL12852743 0.84 MEN1 (0.33) KMT2ALMNAMEN1
SCHEMBL4561446 0.83 TSHR (0.33) DNM1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2341886-B1 ANTIMICROBIAL N-CHLORINATED COMPOSITIONS NOVABAY PHARMACEUTICALS INC (US) 2015-08-26 EP claimed
EP-2341886-B1 ANTIMICROBIAL N-CHLORINATED COMPOSITIONS NOVABAY PHARMACEUTICALS INC (US) 2015-08-26 EP disclosed
US-8278482-B2 Antimicrobial N-chlorinated compositions NOVABAY PHARMACEUTICALS, INC. (US) 2012-10-02 US disclosed
US-20100158818-A1 ANTIMICROBIAL N-CHLORINATED COMPOSITIONS NOVABAY PHARMACEUTICALS, INC. 2010-06-24 US disclosed
WO-2010054269-A1 ANTIMICROBIAL N-CHLORINATED COMPOSITIONS NOVABAY PHARMACEUTICALS, INC. (US) 2010-05-14 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-20100158818-A1 ANTIMICROBIAL N-CHLORINATED COMPOSITIONS NRDC, NHERF1, MPO DNM1 340/4885HTT 2344/4885KMT2A 4214/4885

“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.