SCHEMBL3378425

SCHEMBL3378425

CC1CC(Oc2cc(F)c(CN3CCCC3)c(Cl)c2)C1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 2/20 0.36
GAA P10253 2/20 0.36
HRH3 Q9Y5N1 5/20 0.36
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
ALOX15 P16050 1/20 0.36
CHKA P35790 1/20 0.35
KDM4E B2RXH2 2/20 0.34
TSHR P16473 2/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CYP2A13 Q16696 1/20 0.34
SOS1 Q07889 2/20 0.34
HSD11B1 P28845 1/20 0.33

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
SCHEMBL3378421 0.88 HRH3 (0.36) ADRB2GAAHRH3ALDH1A1TDP1
SCHEMBL3378416 0.88 HRH3 (0.36) ADRB2GAAHRH3ALDH1A1TDP1
SCHEMBL3376428 0.85 GAA (0.36) ADRB2GAAHRH3ALDH1A1TDP1
SCHEMBL3380390 0.81 HRH3 (0.40) ADRB2GAAHRH3ALDH1A1TDP1
SCHEMBL3376427 0.81 HRH3 (0.39) ADRB2GAAHRH3ALDH1A1TDP1
SCHEMBL3376424 0.80 GAA (0.34) ADRB2GAAHRH3ALDH1A1TDP1
SCHEMBL3375072 0.80 HRH3 (0.43) ADRB2GAAHRH3ALDH1A1TDP1
SCHEMBL3375070 0.80 HRH3 (0.43) ADRB2GAAHRH3ALDH1A1TDP1
SCHEMBL3375076 0.78 GAA (0.38) ADRB2GAAHRH3ALDH1A1TDP1
Hydrochloric Acid SCHEMBL3412342 0.75 HRH3 (0.39) ADRB2GAAHRH3ALDH1A1TDP1

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 ADRB2 87/4885GAA 198/4885HRH3 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.