SCHEMBL5555138

SCHEMBL5555138

CC(c1ccc(-c2ccc(-c3cc(Cl)cc(Cl)c3)cc2)cc1)N1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.43
CHRM2 P08172 3/20 0.42
CHRM1 P11229 3/20 0.42
LTA4H P09960 1/20 0.39
MC4R P32245 1/20 0.39
ACHE P22303 2/20 0.38
NEK1 Q96PY6 3/20 0.38
HRH3 Q9Y5N1 2/20 0.36
CHRNA1 P02708 1/20 0.36
CHRNG P07510 1/20 0.36
CHRNB1 P11230 1/20 0.36
CHRNB2 P17787 1/20 0.36
SLC6A2 P23975 1/20 0.36
CHRNB4 P30926 1/20 0.36
SLC6A4 P31645 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36
SLC6A3 Q01959 1/20 0.36
CHRND Q07001 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL6447344 0.83 SLC6A3 (0.48) CYP2D6CHRM2CHRM1SLC6A2SLC6A4
SCHEMBL5554008 0.83 SLC6A3 (0.48) CYP2D6CHRM2CHRM1SLC6A2SLC6A4
SCHEMBL22206767 0.80 CHRM2 (0.57) CYP2D6CHRM2CHRM1LTA4HMC4R
SCHEMBL21075226 0.80 CYP2D6 (0.41) CYP2D6CHRM2CHRM1LTA4HMC4R
SCHEMBL22206739 0.80 CHRM2 (0.57) CYP2D6CHRM2CHRM1LTA4HMC4R
SCHEMBL18571155 0.80 CYP2D6 (0.41) CYP2D6CHRM2CHRM1LTA4HMC4R
SCHEMBL5555164 0.80 CYP2D6 (0.43) CYP2D6CHRM2CHRM1LTA4HMC4R
SCHEMBL6447211 0.80 CYP2D6 (0.40) CYP2D6CHRM2CHRM1LTA4HMC4R
SCHEMBL16982012 0.78 CYP2D6 (0.56) CYP2D6CHRM2CHRM1LTA4HMC4R
SCHEMBL5553102 0.78 BMPR1B (0.42) CYP2D6CHRM2CHRM1LTA4HMC4R

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
EP-1756058-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS Pfizer Products Incorporated (US) 2007-02-28 EP claimed
WO-2005105744-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. 2005-11-10 WO claimed
US-20050245543-A1 Histamine-3 receptor antagonists PFIZER INC 2005-11-03 US claimed
US-20050245543-A1 Histamine-3 receptor antagonists PFIZER INC 2005-11-03 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-20050245543-A1 Histamine-3 receptor antagonists HRH3, HRH4, HRH2 CYP2D6 941/4885CHRM2 180/4885CHRM1 253/4885

“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.