SCHEMBL5796884

SCHEMBL5796884

c1ccc(Oc2cccc(CN3C[C@@H]4[C@@H](COCCCN5CCCCC5)[C@@H]4C3)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.52
KDM4E B2RXH2 4/20 0.51
HRH3 Q9Y5N1 4/20 0.51
ALDH1A1 P00352 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
CACNA1B Q00975 3/20 0.48
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
SLC2A1 P11166 1/20 0.46
TRPV6 Q9H1D0 1/20 0.46
CYP2D6 P10635 1/20 0.45

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
SCHEMBL5796879 1.00 FAAH (0.52) FAAHKDM4EHRH3ALDH1A1TDP1
SCHEMBL5796881 1.00 FAAH (0.52) FAAHKDM4EHRH3ALDH1A1TDP1
SCHEMBL5792971 0.91 HRH3 (0.57) HRH3CACNA1BSLC2A1
SCHEMBL5792965 0.91 HRH3 (0.57) HRH3CACNA1BSLC2A1
SCHEMBL5792968 0.91 HRH3 (0.57) HRH3CACNA1BSLC2A1
SCHEMBL5796712 0.90 FAAH (0.55) FAAHKDM4EHRH3ALDH1A1HPGD
SCHEMBL5796707 0.90 FAAH (0.55) FAAHKDM4EHRH3ALDH1A1HPGD
SCHEMBL5796709 0.90 FAAH (0.55) FAAHKDM4EHRH3ALDH1A1HPGD
SCHEMBL5793644 0.89 HRH3 (0.56) FAAHKDM4EHRH3ALDH1A1CYP2D6
SCHEMBL5793639 0.89 HRH3 (0.56) FAAHKDM4EHRH3ALDH1A1CYP2D6

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 FAAH 151/4885KDM4E 2069/4885HRH3 1/4885

“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.