SCHEMBL4131343

SCHEMBL4131343

Cc1cccc(C)c1-c1ccc2c(c1)CCC(N1CCCC1C)C2

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 1/20 0.37
HTR7 P34969 1/20 0.36
HRH3 Q9Y5N1 8/20 0.36
KCNH2 Q12809 2/20 0.36
GRIA1 P42261 1/20 0.34
CACNG8 Q8WXS5 1/20 0.34
DRD2 P14416 1/20 0.34
MCHR1 Q99705 3/20 0.33
HTR2C P28335 3/20 0.33
HTR2B P41595 3/20 0.33
HTR2A P28223 2/20 0.32
HRH4 Q9H3N8 1/20 0.32

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
SCHEMBL4136027 0.89 ASIC3 (0.39) ASIC3HRH3KCNH2MCHR1HTR2C
SCHEMBL4145172 0.87 CD274 (0.39) ASIC3HRH3KCNH2DRD2HTR2C
SCHEMBL4135556 0.87 CD274 (0.38) ASIC3HTR7HRH3KCNH2GRIA1
SCHEMBL4135521 0.86 CYP11B2 (0.35) HRH3KCNH2DRD2HTR2CHTR2B
SCHEMBL4141100 0.86 HRH3 (0.38) ASIC3HRH3KCNH2DRD2
SCHEMBL4130044 0.85 HRH3 (0.37) ASIC3HRH3KCNH2MCHR1HTR2C
SCHEMBL4132423 0.85 SIGMAR1 (0.38) ASIC3HTR7HRH3HTR2CHTR2B
SCHEMBL4129121 0.84 HRH3 (0.39) ASIC3HRH3KCNH2
SCHEMBL4140206 0.84 HRH3 (0.40) ASIC3HRH3KCNH2MCHR1HTR2C
SCHEMBL4142343 0.84 HRH3 (0.40) ASIC3HRH3KCNH2

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 388/4885HTR7 7/4885HRH3 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.