SCHEMBL26780910

SCHEMBL26780910

Cc1cc(B(O)O)c(Br)c(C)c1C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.32

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
SCHEMBL5951488 0.77 CA2 (0.31) —
SCHEMBL4664515 0.71 — —
SCHEMBL13159993 0.71 ENPP2 (0.42) —
SCHEMBL8909014 0.71 CYP1A2 (0.38) CYP1A2
SCHEMBL7173958 0.70 ALDH1A1 (0.40) CYP1A2
SCHEMBL31088765 0.70 ALDH1A1 (0.40) CYP1A2
SCHEMBL3928078 0.70 CA2 (0.36) CYP1A2
SCHEMBL21218762 0.69 APEX1 (0.38) CYP1A2
SCHEMBL12538859 0.68 BCHE (0.35) —
SCHEMBL31621069 0.68 BCHE (0.35) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11820778-B2 2-azaspiro[3.4]octane derivatives as M4 agonists NOVARTIS AG (CH) 2023-11-21 — — 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-11820778-B2 2-azaspiro[3.4]octane derivatives as M4 agonists CHRM2, CHRM1, CHRM3 CYP1A2 568/4885

“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.

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