SCHEMBL16098006

SCHEMBL16098006

COC(C)(C)CN1CCC(CNC(=O)c2cc(Br)c(N)c3cccnc23)CC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.45
DRD4 P21917 5/20 0.45
DRD3 P35462 5/20 0.45
HTR4 Q13639 3/20 0.44
ACHE P22303 1/20 0.44
GSK3B P49841 3/20 0.41
LIPG Q9Y5X9 1/20 0.41
ACACB O00763 2/20 0.40
ACACA Q13085 2/20 0.40
HTR3E A5X5Y0 1/20 0.40
HTR3B O95264 1/20 0.40
HTR3A P46098 1/20 0.40
HTR3D Q70Z44 1/20 0.40
HTR3C Q8WXA8 1/20 0.40
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL16098024 0.91 HTR4 (0.47) DRD2DRD4DRD3HTR4ACHE
SCHEMBL18094620 0.90 HTR4 (0.42) DRD2DRD4DRD3HTR4GSK3B
SCHEMBL16123295 0.90 HTR3E (0.51) DRD2DRD4DRD3HTR4HTR3E
SCHEMBL18094604 0.84 DRD3 (0.38) DRD2DRD3HTR4HTR3EHTR3B
SCHEMBL16097420 0.82 HTR3E (0.50) DRD2DRD4DRD3HTR4GSK3B
SCHEMBL16098697 0.81 HTR4 (0.47) DRD2DRD4DRD3HTR4ACHE
SCHEMBL16099115 0.81 HTR3E (0.51) DRD2DRD4DRD3HTR4HTR3E
SCHEMBL16102244 0.80 HTR3E (0.54) DRD2DRD4DRD3HTR4HTR3E
SCHEMBL16097911 0.80 HTR4 (0.47) HTR4ACHEGSK3BACACBACACA
SCHEMBL18094609 0.80 HTR3E (0.53) DRD2DRD4DRD3HTR4HTR3E

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
US-9790211-B2 5-amino-quinoline-8-carboxamide derivatives as 5-HT4 receptor agonists SUVEN LIFE SCIENCES LIMITED (IN) 2017-10-17 US claimed
EP-2976337-A1 5-AMINO-QUINOLINE-8-CARBOXAMIDE DERIVATIVES AS 5-HT4 RECEPTOR AGONISTS Suven Life Sciences Limited (IN) 2016-01-27 EP claimed
WO-2014147636-A1 5-AMINO-QUINOLINE-8-CARBOXAMIDE DERIVATIVES AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2014-09-25 WO claimed
EP-2976337-B1 5-AMINO-QUINOLINE-8-CARBOXAMIDE DERIVATIVES AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LTD (IN) 2018-05-02 EP disclosed
EP-2976337-B1 5-AMINO-QUINOLINE-8-CARBOXAMIDE DERIVATIVES AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LTD (IN) 2018-05-02 EP disclosed
US-9790211-B2 5-amino-quinoline-8-carboxamide derivatives as 5-HT4 receptor agonists SUVEN LIFE SCIENCES LIMITED (IN) 2017-10-17 US disclosed
US-9790211-B2 5-amino-quinoline-8-carboxamide derivatives as 5-HT4 receptor agonists SUVEN LIFE SCIENCES LIMITED (IN) 2017-10-17 US disclosed
US-20160280694-A1 5-AMINO-QUINOLINE-8-CARBOXAMIDE DERIVATIVES AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2016-09-29 US disclosed
EP-2976337-A1 5-AMINO-QUINOLINE-8-CARBOXAMIDE DERIVATIVES AS 5-HT4 RECEPTOR AGONISTS Suven Life Sciences Limited (IN) 2016-01-27 EP disclosed
WO-2014147636-A1 5-AMINO-QUINOLINE-8-CARBOXAMIDE DERIVATIVES AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2014-09-25 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-20160280694-A1 5-AMINO-QUINOLINE-8-CARBOXAMIDE DERIVATIVES AS 5-HT4 RECEPTOR AGONISTS HTR4, HTR5A, HTR1A DRD2 195/4885DRD4 165/4885DRD3 339/4885

“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.