SCHEMBL4136847

SCHEMBL4136847

CC1CCCN1C1CCc2cc(-c3ccc(O)cc3)ccc2C1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.39
KCNH2 Q12809 1/20 0.39
OPRK1 P41145 2/20 0.38
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
HTR1A P08908 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
HSD17B1 P14061 2/20 0.35
CHRNA7 P36544 2/20 0.35
DRD2 P14416 1/20 0.35
DRD1 P21728 1/20 0.35
CYP26A1 O43174 1/20 0.34

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
SCHEMBL4135773 0.89 CYP11B1 (0.37) HRH3KCNH2OPRK1OPRM1OPRD1
SCHEMBL4142343 0.89 HRH3 (0.40) HRH3KCNH2
SCHEMBL4140206 0.89 HRH3 (0.40) HRH3KCNH2
SCHEMBL4142298 0.88 HRH3 (0.39) HRH3KCNH2OPRK1OPRM1OPRD1
SCHEMBL4141039 0.88 HRH3 (0.45) HRH3KCNH2OPRM1
SCHEMBL4147612 0.87 HRH3 (0.43) HRH3KCNH2
SCHEMBL4139788 0.86 CYP11B2 (0.39) HRH3KCNH2DRD2
SCHEMBL4129121 0.86 HRH3 (0.39) HRH3KCNH2
SCHEMBL4139793 0.86 CYP11B2 (0.39) HRH3KCNH2DRD2
SCHEMBL4136956 0.85 HRH3 (0.38) HRH3KCNH2

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 1/4885KCNH2 657/4885OPRK1 188/4885

“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.