SCHEMBL4133239

SCHEMBL4133239

CN(C)C(=O)c1ccc(-c2ccc3c(c2)CCC(N2Cc4ccccc4C2)C3)cc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 13/20 0.41
KCNH2 Q12809 5/20 0.41
HDAC4 P56524 1/20 0.41
HTR2C P28335 1/20 0.41
MAP4K1 Q92918 1/20 0.41
HTR1A P08908 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
PDK2 Q15119 1/20 0.39
AKR1C3 P42330 1/20 0.38
FAAH O00519 1/20 0.38

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
SCHEMBL4148572 0.91 AKR1C3 (0.43) MCHR1KCNH2HDAC4MAP4K1HRH3
SCHEMBL4143084 0.86 KCNH2 (0.47) MCHR1KCNH2HTR2CMAP4K1HTR1A
SCHEMBL4136377 0.79 HRH3 (0.52) MCHR1HRH3PDK2
SCHEMBL4136371 0.79 HRH3 (0.52) MCHR1HRH3PDK2
SCHEMBL4136716 0.76 HDAC4 (0.38) HDAC4
SCHEMBL4136657 0.76 HRH3 (0.48) MCHR1KCNH2HTR2CHTR1AHRH3
SCHEMBL4142089 0.75 HRH3 (0.42) MCHR1MAP4K1HRH3PDK2FAAH
SCHEMBL4147507 0.74 MCHR1 (0.41) MCHR1KCNH2HDAC4HTR2CHTR1A
SCHEMBL4136231 0.74 HRH3 (0.45) MCHR1HRH3PDK2
SCHEMBL4139503 0.74 MEN1 (0.44) HTR1AHRH3FAAH

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 MCHR1 287/4885KCNH2 657/4885HDAC4 1125/4885

“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.