SCHEMBL409657

SCHEMBL409657

NOCCOCC(COCCON)(COCCON)COCCON

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ODC1 P11926 1/20 0.32
ADRB2 P07550 1/20 0.30
ADRB1 P08588 1/20 0.30
ADRB3 P13945 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
SCHEMBL19026294 0.77 CA1 (0.33)
SCHEMBL758346 0.75 ODC1 (0.41) ODC1ADRB2ADRB1ADRB3
SCHEMBL667646 0.75
SCHEMBL10076924 0.75 ODC1 (0.41) ODC1ADRB2ADRB1ADRB3
Aminooxyethoxyethoxyethylhydroxylamine SCHEMBL43069 0.75 ODC1 (0.41) ODC1ADRB2ADRB1ADRB3
SCHEMBL11885390 0.75 ODC1 (0.41) ODC1ADRB2ADRB1ADRB3
SCHEMBL77067 0.73
SCHEMBL12210381 0.73
Water SCHEMBL20496293 0.72 ODC1 (0.39) ODC1ADRB2ADRB1ADRB3
SCHEMBL11965457 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210393850-A1 BIOINKS UNIVERSITEIT MAASTRICHT (NL) 2021-12-23 US disclosed
US-20120064061-A1 ADHESIVE COMPOSITION COMPRISING TANNIN, POLY(ETHYLENE GLYCOL), AND WATER, LOWER ALCOHOL OR MIXTURE THEREOF INNOTHERAPY INC. (KR) 2012-03-15 US disclosed
US-8067526-B2 Method for producing polyoxalkylene derivative NOF CORPORATION (JP) 2011-11-29 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-20120064061-A1 ADHESIVE COMPOSITION COMPRISING TANNIN, POLY(ETHYLENE GLYCOL), AND WATER, LOWER ALCOHOL OR MIXTURE THEREOF EPCAM, ICAM1, VCAM1 ODC1 4112/4885ADRB2 3227/4885ADRB1 2923/4885

“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.