SCHEMBL6327299

SCHEMBL6327299

Nc1[nH]c(=O)c(C(=O)NCC2CCN(Cc3ccc(OC(F)(F)F)cc3)CC2)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 4/20 0.54
CHRM2 P08172 2/20 0.50
CHRM1 P11229 2/20 0.50
CHRM5 P08912 1/20 0.50
CHRM3 P20309 1/20 0.50
CCR2 P41597 2/20 0.49
GSK3B P49841 2/20 0.47
CHRM4 P08173 5/20 0.47
DRD2 P14416 3/20 0.46
DRD4 P21917 3/20 0.46
DRD3 P35462 2/20 0.46
KCNH2 Q12809 2/20 0.45
CACNA1I Q9P0X4 2/20 0.45

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
SCHEMBL7254158 0.96 HTR4 (0.51) HTR4CHRM2CHRM1CHRM5CHRM3
SCHEMBL6336300 0.89 CCR2 (0.59) HTR4CCR2GSK3BCHRM4DRD2
SCHEMBL6329186 0.88 HTR4 (0.66) HTR4CCR2DRD2DRD4DRD3
SCHEMBL6329068 0.88 HTR4 (0.56) HTR4CCR2DRD2DRD4DRD3
SCHEMBL6331358 0.87 HTR4 (0.58) HTR4CHRM4DRD2DRD4DRD3
SCHEMBL6331337 0.86 HTR4 (0.50) HTR4CHRM2CHRM1CHRM5CHRM3
SCHEMBL6336876 0.86 HTR4 (0.54) HTR4CCR2DRD2DRD4DRD3
SCHEMBL6329791 0.86 KCNH2 (0.61) HTR4CCR2DRD2DRD4DRD3
SCHEMBL6329269 0.86 DRD2 (0.58) HTR4DRD2DRD4DRD3
SCHEMBL6331374 0.86 HTR4 (0.56) HTR4CCR2GSK3BDRD2DRD4

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 7 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 claimed
US-20030207875-A1 Oxo or oxy-pyridine compounds as 5-HT4 receptor modulators PFIZER INC 2003-11-06 US claimed
EP-1325921-A2 Oxo or oxy-pyridine compounds as 5-HT4 receptor modulators Pfizer Inc. (US) 2003-07-09 EP claimed
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
JP-2003212868-A OXO- OR OXY-PYRIDINE AS 5-HT4 RECEPTOR MODULATOR PFIZER PHARMACEUTICALS INC 2003-07-30 JP 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 254/4885CHRM1 134/4885

“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.