SCHEMBL6328884

SCHEMBL6328884

Nc1[nH]c(=O)c(C(=O)NCC2CCN(CCC3CCCCC3)CC2)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CACNA1I Q9P0X4 4/20 0.53
HTR4 Q13639 10/20 0.48
ACHE P22303 4/20 0.48
KCNH2 Q12809 2/20 0.46
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
P2RX7 Q99572 1/20 0.44

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
SCHEMBL6328190 0.90 HTR4 (0.54) HTR4ACHENPC1RAB9AP2RX7
SCHEMBL6327508 0.88 HTR4 (0.47) CACNA1IHTR4KCNH2
SCHEMBL6335673 0.87 HTR4 (0.49) CACNA1IHTR4KCNH2
SCHEMBL14258189 0.85 NR4A2 (0.53) HTR4
SCHEMBL6331443 0.85 HTR4 (0.48) CACNA1IHTR4KCNH2
SCHEMBL6326538 0.85 HTR4 (0.47) CACNA1IHTR4KCNH2
SCHEMBL6952188 0.84 HTR4 (0.45) CACNA1IHTR4KCNH2
Hydrochloric Acid SCHEMBL6326593 0.84 NR4A2 (0.52) HTR4
SCHEMBL6329265 0.84 HTR4 (0.46) CACNA1IHTR4KCNH2
SCHEMBL6329736 0.84 KCNH2 (0.49) CACNA1IHTR4KCNH2

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 8 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
WO-2003057688-A2 OXO OR OXY-PYRIDINE COMPOUNDS AS 5-HT4 RECEPTOR MODULATORS PFIZER JAPAN INC. (JP) 2003-07-17 WO 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
WO-2003057688-A2 OXO OR OXY-PYRIDINE COMPOUNDS AS 5-HT4 RECEPTOR MODULATORS PFIZER JAPAN INC. (JP) 2003-07-17 WO 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 CACNA1I 1644/4885HTR4 3/4885ACHE 3937/4885

“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.