SCHEMBL3380764

SCHEMBL3380764

Cc1cc(O[C@H]2C[C@H](CN3CCOCC3)C2)cc(C)c1CN1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.47
PDE10A Q9Y233 5/20 0.38
PDE5A O76074 3/20 0.38
PDE11A Q9HCR9 3/20 0.38
THRB P10828 1/20 0.36
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP2A13 Q16696 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPC1 O15118 1/20 0.34

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
SCHEMBL3376052 1.00 HRH3 (0.47) HRH3PDE10APDE5APDE11ATHRB
SCHEMBL3377506 0.85 HRH3 (0.47) HRH3CYP2A13MEN1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL3374796 0.84 HRH3 (0.46) HRH3CYP2A13MEN1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL3374789 0.84 HRH3 (0.46) HRH3CYP2A13MEN1KMT2ASMN1; SMN2
SCHEMBL3377983 0.84 HRH3 (0.51) HRH3THRBALDH1A1KDM4EMEN1
SCHEMBL3377378 0.81 HRH3 (0.53) HRH3CYP2A13SMN1; SMN2
Hydrochloric Acid SCHEMBL3378874 0.80 HRH3 (0.52) HRH3ALDH1A1CYP2A13SMN1; SMN2
Hydrochloric Acid SCHEMBL3378870 0.80 HRH3 (0.52) HRH3ALDH1A1CYP2A13SMN1; SMN2
SCHEMBL3376482 0.79 HRH3 (0.54) HRH3ALDH1A1KDM4ECYP2A13SMN1; SMN2
SCHEMBL3377113 0.79 HRH3 (0.67) HRH3KDM4ESMN1; SMN2

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 5 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 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 HRH3 1/4885PDE10A 2384/4885PDE5A 2401/4885

“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.