SCHEMBL12376851

SCHEMBL12376851

CC1(C)CCCN(CCCOc2ccc(C3=CCN(C(=O)c4cccc5ccccc45)CC3)cc2)C1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GCGR P47871 2/20 0.52
HRH3 Q9Y5N1 2/20 0.51
HRH1 P35367 1/20 0.51
KCNH2 Q12809 1/20 0.47
MAOB P27338 1/20 0.46
BCHE P06276 2/20 0.43
ALDH1A1 P00352 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
S1PR1 P21453 1/20 0.41
S1PR3 Q99500 1/20 0.41

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
SCHEMBL4920804 0.85 HRH3 (0.72) HRH3HRH1KCNH2MAOBMEN1
SCHEMBL3158474 0.84 HRH3 (0.52) HRH3HRH1KCNH2MAOBMEN1
SCHEMBL3158460 0.84 HRH3 (0.52) HRH3HRH1KCNH2MAOBMEN1
SCHEMBL3150503 0.83 HRH3 (0.51) HRH3HRH1KCNH2MAOBS1PR1
SCHEMBL13437974 0.83 HRH3 (0.56) GCGRHRH3HRH1KCNH2MAOB
SCHEMBL3150514 0.82 HRH3 (0.49) HRH3HRH1KCNH2MAOBALDH1A1
SCHEMBL12376850 0.82 HRH3 (0.73) GCGRHRH3HRH1KCNH2MAOB
SCHEMBL13438274 0.81 HRH3 (0.56) GCGRHRH3HRH1KCNH2MAOB
SCHEMBL2284285 0.81 HRH3 (0.60) HRH3HRH1KCNH2MAOBALDH1A1
SCHEMBL3150496 0.81 HRH3 (0.48) HRH3HRH1KCNH2MAOBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989629-B2 3-(4-{ [4-(4-{ [3-(3, 3-dimethyl-1-piperidinyl) propyl] oxy} phenyl)-1-piperidinyl] carbonyl}-1-naphthalenyl) propanoic or propenoic acid as H1 and H3 receptor antagonists for the treatment of inflammatory and/or allergic disorders GLAXO GROUP LIMITED (GB) 2011-08-02 US disclosed
US-20080312280-A1 3- (4-{ [4- (4-{ [3-(3, 3-Dimethyl-1-Piperidinyl) Propyl] Oxy} Phenyl) -1-Piperidinyl] Carbonyl}-1-Naphthalenyl) Propanoic or Propenoic Acid as H1 and H3 Receptor Antagonists for the Treatment of Inflammatory and/or Allergic Disorders GLAXO GROUP LIMITED (GB) 2008-12-18 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-20080312280-A1 3- (4-{ [4- (4-{ [3-(3, 3-Dimethyl-1-Piperidinyl) Propyl] Oxy} Phenyl) -1-Piperidinyl] Carbonyl}-1-Naphthalenyl) Propanoic or Propenoic Acid as H1 and H3 Receptor Antagonists for the Treatment of Inflammatory and/or Allergic Disorders HRH3, HRH1, HRH2 GCGR 662/4885HRH3 1/4885HRH1 2/4885

“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.