SCHEMBL10052607

SCHEMBL10052607

CCOc1ccc2c(c1)[C@]1(C)CCN(Cc3ccccc3)C1N2C

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 11/20 0.69
BCHE P06276 8/20 0.69

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
SCHEMBL12083099 0.89 ACHE (0.72) ACHEBCHE
SCHEMBL14866059 0.87 ACHE (0.54) ACHEBCHE
SCHEMBL10052940 0.86 ACHE (0.55) ACHEBCHE
SCHEMBL2732498 0.83 ACHE (0.67) ACHEBCHE
SCHEMBL8827788 0.83 ACHE (0.67) ACHEBCHE
SCHEMBL8863731 0.80 BCHE (0.72) ACHEBCHE
SCHEMBL8863723 0.80 BCHE (0.72) ACHEBCHE
SCHEMBL9539843 0.80 BCHE (0.72) ACHEBCHE
SCHEMBL9462926 0.79 ACHE (0.67) ACHEBCHE
Hydrochloric Acid SCHEMBL9538512 0.79 BCHE (0.71) ACHEBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130096316-A1 Novel Method for Preparation of Bisnorcymerine and Salts Thereof QR PHARMA, INC. 2013-04-18 US disclosed
US-20130096316-A1 Novel Method for Preparation of Bisnorcymerine and Salts Thereof QR PHARMA, INC. 2013-04-18 US disclosed
US-20130096316-A1 Novel Method for Preparation of Bisnorcymerine and Salts Thereof QR PHARMA, INC. 2013-04-18 US disclosed
WO-2012058031-A2 NOVEL METHOD FOR PREPARATION OF BISNORCYMERINE AND SALTS THEREOF QR PHARMA, INC. (US) 2012-05-03 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-20130096316-A1 Novel Method for Preparation of Bisnorcymerine and Salts Thereof PHOSPHO1, CBS, COASY ACHE 1644/4885BCHE 38/4885

“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.