SCHEMBL13397448

SCHEMBL13397448

CCN(CC1CCN(C)CC1)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.42
CYP2D6 P10635 1/20 0.36
HTR1A P08908 1/20 0.32
ACHE P22303 1/20 0.32
GNAI3 P08754 2/20 0.30
GNAO1 P09471 2/20 0.30
GNAI1 P63096 2/20 0.30
HRH4 Q9H3N8 1/20 0.30
HRH3 Q9Y5N1 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
SCHEMBL15114309 0.83 CYP2D6 (0.30) CYP2D6
SCHEMBL13397416 0.83 HRH3 (0.36) CYP2D6HRH3
SCHEMBL23792429 0.80 NCF1 (0.38) NCF1
SCHEMBL13227039 0.79 ALOX5 (0.33)
SCHEMBL13397286 0.78 NCF1 (0.46) NCF1ACHEHRH4HRH3
SCHEMBL13844016 0.78 CYP1A2 (0.37)
SCHEMBL13397418 0.76 NCF1 (0.45) NCF1ACHEHRH4HRH3
SCHEMBL23560348 0.75 NCF1 (0.48) NCF1HTR1AACHEGNAI3GNAO1
SCHEMBL13361145 0.75 NCF1 (0.48) NCF1HTR1AACHEGNAI3GNAO1
SCHEMBL24818091 0.74

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-20100104659-A1 BENZOPYRANOPYRAZOLES 4SC AG (DE) 2010-04-29 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-20100104659-A1 BENZOPYRANOPYRAZOLES BAX, BCL2, BAD NCF1 720/4885CYP2D6 890/4885HTR1A 3735/4885

“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.