SCHEMBL4133152

SCHEMBL4133152

CC1CCCN1C1CCc2cc(-c3cc(Cl)cc(Cl)c3)ccc2C1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 2/20 0.40
HRH3 Q9Y5N1 10/20 0.39
KCNH2 Q12809 3/20 0.36
CYP3A4 P08684 2/20 0.36
MCHR1 Q99705 6/20 0.33
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
OPRK1 P41145 1/20 0.32
OPRL1 P41146 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
CYP2B6 P20813 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
SCHEMBL4142298 0.91 HRH3 (0.39) ASIC3HRH3KCNH2CYP3A4MCHR1
SCHEMBL4141821 0.88 ALDH1A1 (0.39) ASIC3HRH3KCNH2CYP3A4MCHR1
SCHEMBL4141241 0.87 PGR (0.39) HRH3KCNH2MCHR1
SCHEMBL4139649 0.86 HRH3 (0.37) ASIC3HRH3KCNH2CYP3A4MCHR1
SCHEMBL4136027 0.86 ASIC3 (0.39) ASIC3HRH3KCNH2CYP3A4MCHR1
SCHEMBL4128057 0.85 HRH3 (0.38) ASIC3HRH3KCNH2MCHR1OPRM1
SCHEMBL4128192 0.85 HRH3 (0.39) ASIC3HRH3KCNH2CYP3A4MCHR1
SCHEMBL4142343 0.85 HRH3 (0.40) ASIC3HRH3KCNH2CYP3A4CYP1A2
SCHEMBL4140206 0.85 HRH3 (0.40) ASIC3HRH3KCNH2CYP3A4MCHR1
SCHEMBL4128761 0.84 HRH3 (0.38) ASIC3HRH3KCNH2MCHR1

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 388/4885HRH3 1/4885KCNH2 657/4885

“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.