SCHEMBL4132412

SCHEMBL4132412

Fc1ccc(Cl)cc1-c1ccc2c(c1)CCC(N1CCCC1)C2

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.47
HTR7 P34969 1/20 0.47
OPRM1 P35372 2/20 0.42
OPRD1 P41143 2/20 0.42
OPRK1 P41145 2/20 0.42
OPRL1 P41146 2/20 0.42
HTR1D P28221 2/20 0.38
HTR2A P28223 4/20 0.36
HTR2C P28335 4/20 0.36
GRIN2B Q13224 1/20 0.36
MCHR1 Q99705 2/20 0.35
RORC P51449 1/20 0.35
NOTUM Q6P988 1/20 0.35
SRD5A1 P18405 2/20 0.35
DRD2 P14416 1/20 0.35
KCNH2 Q12809 1/20 0.35
HTR2B P41595 2/20 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
SCHEMBL4130376 0.85 HTR1A (0.43) HTR1AHTR7OPRM1OPRD1OPRK1
SCHEMBL4132535 0.84 OPRM1 (0.44) HTR1AHTR7OPRM1OPRD1OPRK1
SCHEMBL4136629 0.84 OPRM1 (0.44) HTR1AHTR7OPRM1OPRD1OPRK1
SCHEMBL4141143 0.84 OPRM1 (0.44) HTR1AHTR7OPRM1OPRD1OPRK1
SCHEMBL4130877 0.83 HTR1A (0.46) HTR1AHTR7OPRM1OPRD1OPRK1
SCHEMBL4139723 0.83 MCHR1 (0.37) OPRM1OPRD1OPRK1OPRL1HTR2A
SCHEMBL4139998 0.81 HRH3 (0.45) HTR1AHTR7OPRM1OPRD1OPRK1
SCHEMBL4130547 0.80 HTR1A (0.46) HTR1AHTR7OPRM1OPRD1OPRK1
SCHEMBL4133407 0.80 HTR1A (0.43) HTR1AHTR7OPRM1OPRD1OPRK1
SCHEMBL4148545 0.79 HTR1A (0.44) HTR1AHTR7HTR1DHTR2AHTR2C

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 HTR1A 19/4885HTR7 7/4885OPRM1 324/4885

“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.