SCHEMBL6013364

SCHEMBL6013364

O=C(NN1CCCCC1)c1cnc(-c2ccccc2)c(-c2ccccc2)n1.O=C(O)c1cnc(-c2ccccc2)c(-c2ccccc2)n1

nearest known ligand 0.93

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 12/20 0.93
CNR2 P34972 8/20 0.54
HTT P42858 1/20 0.49

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
SCHEMBL4462335 0.96 CNR1 (1.00) CNR1CNR2HTT
SCHEMBL6673240 0.90 CNR1 (0.91) CNR1
SCHEMBL6668995 0.90 CNR1 (0.91) CNR1CNR2
SCHEMBL7264348 0.87 CNR1 (0.92) CNR1CNR2
SCHEMBL4461228 0.84 CNR1 (1.00) CNR1CNR2
SCHEMBL4455016 0.84 CNR1 (1.00) CNR1
SCHEMBL2801501 0.84 CNR1 (1.00) CNR1CNR2
SCHEMBL4456110 0.81 CNR1 (1.00) CNR1CNR2
SCHEMBL4456253 0.80 CNR1 (0.66) CNR1
SCHEMBL30712642 0.80 CNR1 (0.66) CNR1

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-20060134146-A1 Stable dispersion of solid particles comprising a water-insoluble pyrazine compound ASTRAZENECA AB (SE) 2006-06-22 US disclosed
WO-2003051850-A1 PYRAZINE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ASTRAZENECA AB (SE) 2003-06-26 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-20060134146-A1 Stable dispersion of solid particles comprising a water-insoluble pyrazine compound SKP1, SPOP, ABCG2 CNR1 4128/4885CNR2 4310/4885HTT 703/4885

“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.