SCHEMBL6329778

SCHEMBL6329778

COc1nc(N)c(Cl)cc1C(=O)NCC1CCNCC1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 3/20 0.67
HTR3A P46098 1/20 0.57
CHRM1 P11229 13/20 0.50
CHRM2 P08172 3/20 0.50
CHRM4 P08173 3/20 0.50
CHRM3 P20309 3/20 0.50
CHRM5 P08912 2/20 0.50
DRD2 P14416 1/20 0.48

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
SCHEMBL6328956 0.81 HTR4 (0.66) HTR4
SCHEMBL6327502 0.81 HTR4 (0.58) HTR4
SCHEMBL6333842 0.81 HTR4 (0.58) HTR4
SCHEMBL6329052 0.81 HTR4 (0.60) HTR4
SCHEMBL1502177 0.81 CHEK1 (0.44) HTR4HTR3ADRD2
Hydrochloric Acid SCHEMBL6329100 0.80 HTR4 (0.65) HTR4
SCHEMBL6328871 0.80 KDM4E (0.53) HTR4DRD2
SCHEMBL7260087 0.80 HTR4 (0.57) HTR4HTR3ACHRM1CHRM2CHRM4
SCHEMBL725669 0.80 HTR4 (1.00) HTR4HTR3ADRD2
Hydrochloric Acid SCHEMBL7035321 0.79 HTR4 (0.98) HTR4HTR3ADRD2

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 4 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
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 HTR4 3/4885HTR3A 72/4885CHRM1 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.