SCHEMBL2715902

SCHEMBL2715902

CC1(C)CN(CCO)C(=O)N1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 1/20 0.49
KMT2A Q03164 3/20 0.35
CHRM3 P20309 3/20 0.34
MEN1 O00255 2/20 0.33
ALDH1A1 P00352 1/20 0.33
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
RECQL P46063 1/20 0.31
BLM P54132 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
OPRM1 P35372 1/20 0.30
OPRL1 P41146 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
SCHEMBL7336615 0.80 PLA2G7 (0.49) PLA2G7CHRM3
SCHEMBL5148891 0.80 PLA2G7 (0.49) PLA2G7CHRM3
SCHEMBL2714244 0.80 PLA2G7 (0.49) PLA2G7CHRM3
SCHEMBL2185862 0.77 PLA2G7 (0.47) PLA2G7CHRM3ALDH1A1KDM4ELMNA
SCHEMBL13293918 0.77 CHRM3 (0.56) PLA2G7KMT2ACHRM3MEN1POLB
SCHEMBL14734296 0.77 PLA2G7 (0.45) PLA2G7CHRM3KDM4ELMNAPOLB
SCHEMBL2714868 0.76 KMT2A (0.32) PLA2G7KMT2A
SCHEMBL6113637 0.75 PLA2G7 (0.43) PLA2G7CHRM3POLBBLM
SCHEMBL2713645 0.75 PLA2G7 (0.44) PLA2G7POLB
Acetic Acid SCHEMBL3243807 0.73 CHRM3 (0.49) PLA2G7CHRM3MAPT

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 8 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

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 PLA2G7 2350/4885KMT2A 4521/4885CHRM3 4790/4885

“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.