SCHEMBL584287

SCHEMBL584287

CN(C(=O)O)c1ccc2c(c1)nc(C(C)(C)C)n2CC1CCOCC1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 20/20 0.64
CNR1 P21554 1/20 0.57
KCNH2 Q12809 1/20 0.53

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
SCHEMBL3979588 0.90 CNR2 (0.63) CNR2CNR1KCNH2
SCHEMBL585319 0.86 CNR2 (0.61) CNR2CNR1KCNH2
SCHEMBL5181379 0.85 CNR2 (0.66) CNR2CNR1KCNH2
SCHEMBL4968683 0.85 CNR2 (0.59) CNR2CNR1
SCHEMBL3916373 0.85 CNR2 (0.69) CNR2CNR1KCNH2
SCHEMBL585337 0.84 CNR2 (0.56) CNR2CNR1
SCHEMBL5434787 0.84 CNR2 (0.49) CNR2CNR1KCNH2
SCHEMBL4968426 0.84 CNR2 (0.65) CNR2CNR1KCNH2
SCHEMBL4459897 0.83 CNR2 (0.66) CNR2CNR1
SCHEMBL585606 0.83 CNR2 (0.69) CNR2CNR1KCNH2

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
EP-1797077-B1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF I ASTRAZENECA AB (SE) 2012-02-15 EP disclosed
US-20070072853-A1 Benzimidazole derivatives compositions containing them, preparation thereof and uses thereof ASTRAZENECA AB (SE) 2007-03-29 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-20070072853-A1 Benzimidazole derivatives compositions containing them, preparation thereof and uses thereof RB1, CYP2C19, ADRB3 CNR2 202/4885CNR1 182/4885KCNH2 297/4885

“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.