SCHEMBL5793646

SCHEMBL5793646

COc1cccc(CN2C[C@@H]3C(COCCCN4CCCCC4)[C@@H]3C2)c1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.56
SIGMAR1 Q99720 4/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
FAAH O00519 1/20 0.48
LTA4H P09960 1/20 0.47
ACHE P22303 2/20 0.46
BCHE P06276 1/20 0.46
CYP2D6 P10635 1/20 0.46

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
SCHEMBL5793639 1.00 HRH3 (0.56) HRH3SIGMAR1KMT2AMEN1KDM4E
SCHEMBL5793644 1.00 HRH3 (0.56) HRH3SIGMAR1KMT2AMEN1KDM4E
SCHEMBL5796881 0.89 FAAH (0.52) HRH3KDM4EALDH1A1FAAHCYP2D6
SCHEMBL5796879 0.89 FAAH (0.52) HRH3KDM4EALDH1A1FAAHCYP2D6
SCHEMBL5796884 0.89 FAAH (0.52) HRH3KDM4EALDH1A1FAAHCYP2D6
SCHEMBL5796896 0.87 HRH3 (0.55) HRH3ACHE
SCHEMBL5796894 0.87 HRH3 (0.55) HRH3ACHE
SCHEMBL5796893 0.87 HRH3 (0.55) HRH3ACHE
SCHEMBL5796707 0.87 FAAH (0.55) HRH3KDM4EALDH1A1FAAHLTA4H
SCHEMBL5796712 0.87 FAAH (0.55) HRH3KDM4EALDH1A1FAAHLTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006024955-A1 AZABICYCLIC AMINE HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2006-03-09 WO claimed
US-20060047114-A1 Azabicyclic amine histamine-3 receptor antagonists PFIZER INC 2006-03-02 US claimed
US-20060047114-A1 Azabicyclic amine histamine-3 receptor antagonists PFIZER INC 2006-03-02 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-20060047114-A1 Azabicyclic amine histamine-3 receptor antagonists HRH3, HRH4, HRH2 HRH3 1/4885SIGMAR1 1354/4885KMT2A 774/4885

“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.