SCHEMBL4128761

SCHEMBL4128761

CC(C)c1ccc(-c2ccc3c(c2)CCC(N2CCCC2C)C3)cc1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.38
KCNH2 Q12809 5/20 0.38
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
ACHE P22303 3/20 0.34
KDM2B Q8NHM5 1/20 0.33
ASIC3 Q9UHC3 1/20 0.33
BCHE P06276 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MCHR1 Q99705 1/20 0.32
ADRB3 P13945 2/20 0.31
ADRB1 P08588 1/20 0.31

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
SCHEMBL4142137 0.89 HRH3 (0.35) HRH3KCNH2ASIC3MCHR1ADRB3
SCHEMBL4142298 0.88 HRH3 (0.39) HRH3KCNH2ASIC3MCHR1ADRB3
SCHEMBL4141821 0.87 ALDH1A1 (0.39) HRH3KCNH2ASIC3MCHR1ADRB3
SCHEMBL4140206 0.86 HRH3 (0.40) HRH3KCNH2ASIC3MCHR1ADRB3
SCHEMBL4142343 0.86 HRH3 (0.40) HRH3KCNH2ASIC3
SCHEMBL4141039 0.85 HRH3 (0.45) HRH3KCNH2MCHR1
SCHEMBL4136847 0.85 HRH3 (0.39) HRH3KCNH2
SCHEMBL4152815 0.85 GRIN2D (0.36) HRH3KCNH2
SCHEMBL4139788 0.84 CYP11B2 (0.39) HRH3KCNH2MAPTASIC3MCHR1
SCHEMBL4133152 0.84 ASIC3 (0.40) HRH3KCNH2ASIC3MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR MCHARDY STANTON FURST 2009-06-25 US claimed

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-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR HRH3, HRH4, HRH1 HRH3 1/4885KCNH2 657/4885TP53 4132/4885

“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.