SCHEMBL6328684

SCHEMBL6328684

COC(=O)CCCCN1CCC(CNC(=O)c2cc(Cl)c(N)[nH]c2=O)CC1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 16/20 0.52
CHRM2 P08172 1/20 0.46
ADRA2B P18089 1/20 0.46
HRH2 P25021 1/20 0.46
HTR1D P28221 1/20 0.46
HTR2A P28223 1/20 0.46
HRH1 P35367 1/20 0.46
HTR2B P41595 1/20 0.46
HTR3A P46098 1/20 0.46
SIGMAR1 Q99720 1/20 0.46

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
SCHEMBL6327458 0.97 HTR4 (0.53) HTR4
SCHEMBL7257589 0.97 HTR4 (0.49) HTR4CHRM2ADRA2BHRH2HTR1D
SCHEMBL7259539 0.95 HTR4 (0.51) HTR4
SCHEMBL6329092 0.94 HTR4 (0.50) HTR4
SCHEMBL6329579 0.90 HTR4 (0.54) HTR4
SCHEMBL7257668 0.88 HTR4 (0.49) HTR4
SCHEMBL6329818 0.88 HTR4 (0.51) HTR4
SCHEMBL6328192 0.88 HTR4 (0.51) HTR4
SCHEMBL14258189 0.88 NR4A2 (0.53) HTR4
Hydrochloric Acid SCHEMBL6326593 0.87 NR4A2 (0.52) HTR4

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-6979690-B2 Oxo or oxy-pyridine compounds as 5-HT4 receptor modulators PFIZER INC. (US) 2005-12-27 US disclosed
US-20030207875-A1 Oxo or oxy-pyridine compounds as 5-HT4 receptor modulators PFIZER INC 2003-11-06 US disclosed
EP-1325921-A2 Oxo or oxy-pyridine compounds as 5-HT4 receptor modulators Pfizer Inc. (US) 2003-07-09 EP disclosed

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-20030207875-A1 Oxo or oxy-pyridine compounds as 5-HT4 receptor modulators HRH4, HRH2, HTR4 HTR4 3/4885CHRM2 254/4885ADRA2B 176/4885

“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.