SCHEMBL3380004

SCHEMBL3380004

COCCC(=O)NCC1CC(Oc2ccc(CN3CCCC3)cc2)C1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
KCNH2 Q12809 4/20 0.45
MCHR1 Q99705 4/20 0.45
HRH3 Q9Y5N1 3/20 0.45
FAAH O00519 4/20 0.45
ACHE P22303 3/20 0.45
ADRB2 P07550 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
BCHE P06276 1/20 0.43
CCR2 P41597 1/20 0.42

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
SCHEMBL3379190 0.89 FAAH (0.51) KCNH2MCHR1HRH3FAAHACHE
SCHEMBL3377442 0.87 ADRB2 (0.49) KCNH2MCHR1HRH3FAAHACHE
SCHEMBL3376675 0.86 HRH3 (0.51) KCNH2MCHR1HRH3FAAHADRB2
SCHEMBL3377240 0.84 HRH3 (0.51) POLBKCNH2MCHR1HRH3FAAH
SCHEMBL4645798 0.84 HRH3 (0.48) KCNH2MCHR1HRH3FAAHACHE
SCHEMBL3378858 0.83 HRH3 (0.48) KCNH2MCHR1HRH3FAAHACHE
SCHEMBL3378855 0.83 HRH3 (0.48) KCNH2MCHR1HRH3FAAHACHE
SCHEMBL3377693 0.83 FAAH (0.47) KCNH2MCHR1HRH3FAAHACHE
SCHEMBL3378373 0.82 HRH3 (0.53) KCNH2MCHR1HRH3ADRB2MEN1
SCHEMBL4649043 0.81 HRH3 (0.50) KCNH2MCHR1HRH3ADRB2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1899296-B1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PROD INC (US) 2010-11-17 EP claimed
US-7812040-B2 such as 3-(3-Acetyl-phenyl)-1-[3-(3-chloro-4-pyrrolidin-1-ylmethyl-phenoxy)-cyclobutylmethyl]-1-methyl-urea, used for the treatment of , schizophrenia, Alzheimer's disease, attention-deficit hyperactivity disorder, hypotension, allergies, cardiovascular, gastrointestinal and psychological disorders PFIZER INC. (US) 2010-10-12 US claimed
US-20090131433-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER INC. (US) 2009-05-21 US claimed
EP-1899296-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS Pfizer Products Incorporated (US) 2008-03-19 EP claimed
WO-2006136924-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2006-12-28 WO claimed
EP-1899296-B1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PROD INC (US) 2010-11-17 EP disclosed
US-7812040-B2 such as 3-(3-Acetyl-phenyl)-1-[3-(3-chloro-4-pyrrolidin-1-ylmethyl-phenoxy)-cyclobutylmethyl]-1-methyl-urea, used for the treatment of , schizophrenia, Alzheimer's disease, attention-deficit hyperactivity disorder, hypotension, allergies, cardiovascular, gastrointestinal and psychological disorders PFIZER INC. (US) 2010-10-12 US disclosed
US-20090131433-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER INC. (US) 2009-05-21 US disclosed
EP-1899296-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS Pfizer Products Incorporated (US) 2008-03-19 EP disclosed
WO-2006136924-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2006-12-28 WO 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-20090131433-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS HRH3, HRH4, HRH2 POLB 1820/4885KCNH2 877/4885MCHR1 312/4885

“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.