SCHEMBL4140975

SCHEMBL4140975

CC1CCCN1C1CCc2cc(-c3cccc(OC(F)(F)F)c3)ccc2C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.45
HRH3 Q9Y5N1 3/20 0.42
MCHR1 Q99705 2/20 0.41
CYP11B1 P15538 2/20 0.41
CYP11B2 P19099 2/20 0.41
OTUD7B Q6GQQ9 2/20 0.38
SLC6A4 P31645 1/20 0.38
TMEM97 Q5BJF2 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
MAP4K1 Q92918 1/20 0.37
JAK2 O60674 1/20 0.37
ROCK2 O75116 1/20 0.37
PRKD3 O94806 1/20 0.37
PRKCG P05129 1/20 0.37
PHKG2 P15735 1/20 0.37
RPS6KB1 P23443 1/20 0.37
MARK3 P27448 1/20 0.37
PRKCI P41743 1/20 0.37
CLK2 P49760 1/20 0.37
IRAK1 P51617 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
SCHEMBL4136097 0.87 TMEM97 (0.46) HRH3MCHR1CYP11B1CYP11B2SLC6A4
SCHEMBL4135775 0.84 HTR2C (0.41) HRH3CYP11B1CYP11B2TMEM97SIGMAR1
SCHEMBL4130668 0.84 ASIC3 (0.46) HRH3MCHR1CYP11B1CYP11B2
SCHEMBL4766770 0.84 S1PR1 (0.45) HRH3SCN9A
SCHEMBL4132406 0.83 MCHR1 (0.37) HRH3MCHR1CYP11B1CYP11B2
SCHEMBL4129121 0.82 HRH3 (0.39) USP30HRH3CYP11B1CYP11B2SLC6A4
SCHEMBL4142343 0.82 HRH3 (0.40) USP30HRH3CYP11B1CYP11B2BACE1
SCHEMBL4141100 0.82 HRH3 (0.38) HRH3CYP11B1CYP11B2SIGMAR1
SCHEMBL4141225 0.81 HRH3 (0.49) HRH3TMEM97SIGMAR1BACE1
SCHEMBL4152745 0.81 HRH3 (0.46) HRH3MCHR1BACE1

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 3 patents. 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
EP-2007749-A2 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR Pfizer Products Inc. (US) 2008-12-31 EP claimed
WO-2007105053-A2 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR PFIZER PRODUCTS INC. (US) 2007-09-20 WO 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 USP30 3191/4885HRH3 1/4885MCHR1 287/4885

“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.