SCHEMBL6329528

SCHEMBL6329528

Nc1[nH]c(=O)c(C(=O)NCC2CCN(Cc3ccccc3C(F)(F)F)CC2)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 5/20 0.46
ACHE P22303 2/20 0.45
FAAH O00519 1/20 0.45
BCHE P06276 1/20 0.45
LMNA P02545 2/20 0.44
TP53 P04637 1/20 0.44
CCR2 P41597 1/20 0.44
KCNH2 Q12809 1/20 0.44
CACNA1I Q9P0X4 1/20 0.44
POLB P06746 1/20 0.44
DRD2 P14416 2/20 0.44
DRD4 P21917 2/20 0.44
DRD3 P35462 2/20 0.44
CHRM1 P11229 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PARP1 P09874 1/20 0.42
SIGMAR1 Q99720 1/20 0.42

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
SCHEMBL6329798 0.90 HTR4 (0.52) HTR4ACHEFAAHBCHELMNA
SCHEMBL6329577 0.89 TP53 (0.54) HTR4LMNATP53POLBDRD2
SCHEMBL6331337 0.87 HTR4 (0.50) HTR4LMNATP53POLBDRD2
SCHEMBL6329595 0.87 HTR4 (0.48) HTR4ACHELMNATP53POLB
SCHEMBL6329269 0.85 DRD2 (0.58) HTR4ACHEDRD2DRD4DRD3
SCHEMBL6334906 0.85 HTR4 (0.47) HTR4ACHELMNATP53POLB
SCHEMBL6336300 0.85 CCR2 (0.59) HTR4ACHECCR2KCNH2CACNA1I
SCHEMBL6333935 0.84 HTR4 (0.46) HTR4ACHELMNATP53POLB
SCHEMBL7259558 0.84 HTR4 (0.46) HTR4ACHELMNATP53POLB
SCHEMBL6329113 0.84 KCNH2 (0.65) HTR4ACHECCR2KCNH2CACNA1I

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 3/4885ACHE 3937/4885FAAH 630/4885

“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.