SCHEMBL5318150

SCHEMBL5318150

Nc1c(Cl)cc(C(=O)NCC2CCNCC2)c2c1CCCO2

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 4/20 0.53
HTR3A P46098 3/20 0.49
HTR3E A5X5Y0 1/20 0.49
HTR3B O95264 1/20 0.49
HTR3D Q70Z44 1/20 0.49
HTR3C Q8WXA8 1/20 0.49
CHRM1 P11229 10/20 0.48
CHRM2 P08172 3/20 0.48
CHRM4 P08173 3/20 0.48
CHRM3 P20309 3/20 0.48
CHRM5 P08912 2/20 0.48
HTR1A P08908 1/20 0.44
ADRA2C P18825 1/20 0.44
ACHE P22303 1/20 0.44
PTGS1 P23219 1/20 0.44
ADRA1A P35348 1/20 0.44
KCNH2 Q12809 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
SCHEMBL5316448 0.88 PIM1 (0.45) HTR4HTR3ACHRM1CHRM2CHRM4
SCHEMBL506271 0.86 HTR4 (0.57) HTR4HTR3ACHRM1CHRM2CHRM4
Hydrochloric Acid SCHEMBL27347764 0.85 HTR4 (0.56) HTR4HTR3ACHRM1CHRM2CHRM4
SCHEMBL17978230 0.84 HTR4 (0.50) HTR4HTR3AHTR3EHTR3BHTR3D
SCHEMBL17978305 0.84 HTR4 (0.54) HTR4HTR3AHTR3EHTR3BHTR3D
SCHEMBL17978242 0.83 HTR4 (0.53) HTR4HTR3AHTR3EHTR3BHTR3D
SCHEMBL2329533 0.82 HTR4 (0.51) HTR4HTR3AHTR3EHTR3BHTR3D
SCHEMBL2329530 0.82 HTR4 (0.51) HTR4HTR3AHTR3EHTR3BHTR3D
SCHEMBL505450 0.81 HTR4 (0.58) HTR4HTR3AHTR3EHTR3BHTR3D
SCHEMBL17978155 0.81 HTR4 (0.49) HTR4HTR3AHTR3EHTR3BHTR3D

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107406434-B As 5-HT4Amide compounds of receptor agonists 苏文生命科学有限公司 2020-09-11 CN disclosed
EP-3265459-B1 AMIDE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LTD (IN) 2019-05-15 EP disclosed
EP-3265459-B1 AMIDE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LTD (IN) 2019-05-15 EP disclosed
US-9957257-B2 Amide compounds as 5-HT4 receptor agonists SUVEN LIFE SCIENCES LIMITED (IN) 2018-05-01 US disclosed
US-9957257-B2 Amide compounds as 5-HT4 receptor agonists SUVEN LIFE SCIENCES LIMITED (IN) 2018-05-01 US disclosed
US-20180051011-A1 AMIDE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2018-02-22 US disclosed
US-20180051011-A1 AMIDE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2018-02-22 US disclosed
EP-3265459-A1 AMIDE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS Suven Life Sciences Limited (IN) 2018-01-10 EP disclosed
WO-2016128990-A1 AMIDE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2016-08-18 WO disclosed
WO-2007068739-A1 4-AMINO-BENZAMIDE DERIVATIVES AS 5-HT4 RECEPTOR AGONISTS FOR THE TREATMENT OF GASTROINTESTINAL, NEUROLOGICAL AND CARDIOVASCULAR DISORDERS GLAXO GROUP LIMITED (GB) 2007-06-21 WO 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-20180051011-A1 AMIDE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS HTR4, HTR5A, HTR1A HTR4 1/4885HTR3A 10/4885HTR3E 18/4885

“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.