SCHEMBL4142009

SCHEMBL4142009

CC1CCCN1C1CCc2cc(-c3ccc(OCc4ccccc4)cc3F)ccc2C1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.48
CYP2D6 P10635 3/20 0.48
BACE1 P56817 1/20 0.45
HRH1 P35367 1/20 0.41
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
GRIN3A Q8TCU5 1/20 0.39
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
FAAH O00519 4/20 0.37
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 1/20 0.37

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
SCHEMBL4135788 0.88 HRH3 (0.51) HRH3CYP2D6BACE1HRH1GRIN2D
SCHEMBL4141225 0.86 HRH3 (0.49) HRH3CYP2D6BACE1HRH1GRIN2D
SCHEMBL4128063 0.86 HRH3 (0.54) HRH3CYP2D6BACE1HRH1GRIN2B
SCHEMBL4136060 0.85 HRH3 (0.43) HRH3CYP2D6BACE1
SCHEMBL4136470 0.85 HRH3 (0.47) HRH3CYP2D6BACE1
SCHEMBL4131479 0.83 HRH3 (0.40) HRH3
SCHEMBL4127329 0.82 HTR1A (0.42) HRH3
SCHEMBL4130994 0.81 HRH3 (0.41) HRH3MAOAMAOB
SCHEMBL4148990 0.78 HRH3 (0.36) HRH3BACE1GRIN2BFAAH
SCHEMBL4152745 0.77 HRH3 (0.46) HRH3CYP2D6BACE1FAAH

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 1/4885CYP2D6 1777/4885BACE1 450/4885

“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.