SCHEMBL3250648

SCHEMBL3250648

CCCCCCCCCCCCN(C)CCC(C)(C)N

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 4/20 0.49
FDPS P14324 2/20 0.49
AGTR1 P30556 1/20 0.49
OPRM1 P35372 1/20 0.49
PDE3A Q14432 1/20 0.49
S1PR2 O95136 1/20 0.48
S1PR1 P21453 1/20 0.48
S1PR3 Q99500 1/20 0.48
S1PR5 Q9H228 1/20 0.48
DNM1 Q05193 3/20 0.44
CHRM2 P08172 1/20 0.43
KDM5A P29375 3/20 0.38
KDM4C Q9H3R0 2/20 0.38
PHF8 Q9UPP1 1/20 0.38
SMPD1 P17405 4/20 0.35
KDM5C P41229 1/20 0.35
KDM5B Q9UGL1 1/20 0.35

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
SCHEMBL3250528 1.00 GGPS1 (0.49) GGPS1FDPSAGTR1OPRM1PDE3A
SCHEMBL3250501 0.91 FDPS (0.43) GGPS1FDPSAGTR1OPRM1PDE3A
SCHEMBL12852946 0.82 ARG1 (0.41) GGPS1FDPSAGTR1OPRM1PDE3A
SCHEMBL7948131 0.82 GRM4 (0.40) CHRM2
SCHEMBL11091899 0.81 DNM1 (0.46) GGPS1FDPSAGTR1OPRM1PDE3A
SCHEMBL12799768 0.81 ARG1 (0.41) GGPS1FDPSAGTR1OPRM1PDE3A
SCHEMBL23502354 0.79 DNM1 (0.67) GGPS1FDPSAGTR1OPRM1PDE3A
SCHEMBL10677607 0.79 DNM1 (0.67) GGPS1FDPSAGTR1OPRM1PDE3A
SCHEMBL9304444 0.79 DNM1 (0.67) GGPS1FDPSAGTR1OPRM1PDE3A
SCHEMBL25463105 0.79 DNM1 (0.67) GGPS1FDPSAGTR1OPRM1PDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 GGPS1 3992/4885FDPS 3927/4885AGTR1 1358/4885

“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.