SCHEMBL2716019

SCHEMBL2716019

COCCOCCOCCN1C(=O)NC(C)(C)C1=O

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.63
SMN1; SMN2 Q16637 2/20 0.54
LMNA P02545 2/20 0.54
POLB P06746 1/20 0.52
PLA2G7 Q13093 1/20 0.51
HTT P42858 2/20 0.47
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
RAB9A P51151 1/20 0.46
GAA P10253 1/20 0.45
ALOX15 P16050 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL15424627 0.90 POLB (0.59) ALDH1A1SMN1; SMN2LMNAPOLBPLA2G7
SCHEMBL8282723 0.89 SMN1; SMN2 (0.56) ALDH1A1SMN1; SMN2LMNAPOLBHTT
SCHEMBL2712390 0.85 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2LMNAPOLBPLA2G7
SCHEMBL2712927 0.84 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2LMNAPOLBPLA2G7
SCHEMBL8282749 0.83 SMN1; SMN2 (0.59) ALDH1A1SMN1; SMN2LMNAPOLBPLA2G7
SCHEMBL11750487 0.83 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2LMNAPOLBPLA2G7
SCHEMBL21129242 0.83 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2LMNAPOLBPLA2G7
SCHEMBL11755762 0.81 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2LMNAPOLBPLA2G7
SCHEMBL15112955 0.80 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2LMNAPOLBPLA2G7
SCHEMBL11694927 0.78 POLB (0.68) ALDH1A1SMN1; SMN2LMNAPOLBPLA2G7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9248117-B2 Substituted N,N-dihaloamines as antimicrobials NOVABAY PHARMACEUTICALS, INC. (US) 2016-02-02 US disclosed
US-9248117-B2 Substituted N,N-dihaloamines as antimicrobials NOVABAY PHARMACEUTICALS, INC. (US) 2016-02-02 US disclosed
US-9248117-B2 Substituted N,N-dihaloamines as antimicrobials NOVABAY PHARMACEUTICALS, INC. (US) 2016-02-02 US disclosed
EP-2629607-A2 ANTIMICROBIAL POLYETHER AND POLYOL COMPOUNDS NovaBay Pharmaceuticals, Inc. (US) 2013-08-28 EP disclosed
US-20120129793-A1 Antimicrobial Polyether and Polyol Compounds NOVABAY PHARMACEUTICALS, INC. 2012-05-24 US disclosed
US-20120129793-A1 Antimicrobial Polyether and Polyol Compounds NOVABAY PHARMACEUTICALS, INC. 2012-05-24 US disclosed
US-20120129793-A1 Antimicrobial Polyether and Polyol Compounds NOVABAY PHARMACEUTICALS, INC. 2012-05-24 US disclosed
WO-2012054521-A2 ANTIMICROBIAL POLYETHER AND POLYOL COMPOUNDS NOVABAY PHARMACEUTICLAS, INC. (US) 2012-04-26 WO disclosed
WO-2012054521-A2 ANTIMICROBIAL POLYETHER AND POLYOL COMPOUNDS NOVABAY PHARMACEUTICLAS, INC. (US) 2012-04-26 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-20120129793-A1 Antimicrobial Polyether and Polyol Compounds POLR1C, DPM1, PRF1 ALDH1A1 1198/4885SMN1; SMN2 2872/4885LMNA 2601/4885

“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.