SCHEMBL4130877

SCHEMBL4130877

Fc1ccc(-c2ccc3c(c2)CCC(N2CCCC2)C3)cc1F

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.46
HTR7 P34969 1/20 0.46
HTR1D P28221 2/20 0.41
HRH3 Q9Y5N1 1/20 0.40
GRIN2B Q13224 2/20 0.40
CYP11B2 P19099 3/20 0.39
CYP17A1 P05093 2/20 0.39
CYP3A4 P08684 2/20 0.39
DRD2 P14416 1/20 0.38
HTR2A P28223 1/20 0.38
CYP11B1 P15538 2/20 0.38
PGR P06401 3/20 0.37
FAAH O00519 1/20 0.37
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
OPRL1 P41146 1/20 0.36
FYN P06241 1/20 0.36

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
SCHEMBL4133407 0.88 HTR1A (0.43) HTR1AHTR7HTR1DGRIN2BDRD2
SCHEMBL4130376 0.88 HTR1A (0.43) HTR1AHTR7HTR1DGRIN2BDRD2
SCHEMBL4148545 0.87 HTR1A (0.44) HTR1AHTR7HTR1DHRH3GRIN2B
SCHEMBL4135988 0.85 HTR1A (0.49) HTR1AHTR7HTR1DHRH3GRIN2B
SCHEMBL4136479 0.85 NAAA (0.51) HTR1AHTR7CYP11B2CYP3A4CYP11B1
SCHEMBL4132535 0.84 OPRM1 (0.44) HTR1AHTR7HTR1DHRH3GRIN2B
SCHEMBL4136629 0.84 OPRM1 (0.44) HTR1AHTR7HTR1DHRH3GRIN2B
SCHEMBL4141143 0.84 OPRM1 (0.44) HTR1AHTR7HTR1DHRH3GRIN2B
SCHEMBL4141125 0.84 HTR1A (0.47) HTR1AHTR7HTR1DHRH3GRIN2B
SCHEMBL4132412 0.83 HTR1A (0.47) HTR1AHTR7HTR1DGRIN2BDRD2

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 HTR1A 19/4885HTR7 7/4885HTR1D 25/4885

“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.