SCHEMBL4136027

SCHEMBL4136027

CC1CCCN1C1CCc2cc(-c3c(Cl)cccc3Cl)ccc2C1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 1/20 0.39
MCHR1 Q99705 5/20 0.37
HRH3 Q9Y5N1 7/20 0.35
KCNH2 Q12809 3/20 0.35
GRM2 Q14416 1/20 0.34
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33
FABP3 P05413 1/20 0.32
FABP4 P15090 1/20 0.32
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
HTR2A P28223 1/20 0.31
CYP3A4 P08684 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
SCHEMBL4131343 0.89 ASIC3 (0.37) ASIC3MCHR1HRH3KCNH2HTR2C
SCHEMBL4135842 0.88 CNR2 (0.43) ASIC3MCHR1HRH3KCNH2FABP4
SCHEMBL4128118 0.87 PDK1 (0.42) ASIC3MCHR1HRH3KCNH2HTR2C
SCHEMBL4141821 0.86 ALDH1A1 (0.39) ASIC3MCHR1HRH3KCNH2CYP3A4
SCHEMBL4133152 0.86 ASIC3 (0.40) ASIC3MCHR1HRH3KCNH2CYP3A4
SCHEMBL4142298 0.84 HRH3 (0.39) ASIC3MCHR1HRH3KCNH2HTR2C
SCHEMBL4132423 0.84 SIGMAR1 (0.38) ASIC3HRH3HTR2CHTR2BHTR2A
SCHEMBL4129121 0.83 HRH3 (0.39) ASIC3HRH3KCNH2CYP3A4
SCHEMBL4142343 0.83 HRH3 (0.40) ASIC3HRH3KCNH2CYP3A4
SCHEMBL4141241 0.83 PGR (0.39) MCHR1HRH3KCNH2GRM2HTR2C

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 ASIC3 388/4885MCHR1 287/4885HRH3 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.