SCHEMBL3559423

SCHEMBL3559423

COc1cc(N2CCN(C3CCN(F)C(c4cccc5cccnc45)C3)CC2)c2ncccc2c1

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 20/20 0.70

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
Hydrochloric Acid SCHEMBL4343506 0.99 HTR1A (0.69) HTR1A
Hydrochloric Acid SCHEMBL4559862 0.98 HTR1A (0.68) HTR1A
Hydrochloric Acid SCHEMBL4337711 0.98 HTR1A (0.68) HTR1A
SCHEMBL4350020 0.88 HTR1A (0.68) HTR1A
SCHEMBL4347680 0.84 HTR1A (0.52) HTR1A
SCHEMBL3557770 0.83 HTR1A (1.00) HTR1A
SCHEMBL3559471 0.80 HTR1A (1.00) HTR1A
SCHEMBL3562420 0.79 HTR1A (1.00) HTR1A
SCHEMBL3560400 0.79 HTR1A (0.81) HTR1A
SCHEMBL28770623 0.78 HTR1A (0.85) HTR1A

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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2029577-A2 CRYSTALLINE FORMS OF 6-METHOXY-8-[4-(1-(5-FLUORO)-QUINOLIN-8-YL-PIPERIDIN-4-YL)-PIPERAZIN-1-YL]-QUINOLINE Wyeth (US) 2009-03-04 EP claimed
EP-2027112-A2 SUCCINATE SALTS OF 6-METHOXY-8-[4-(1-(5-FLUORO)-QUINOLIN-8-YL-PIPERIDIN-4-YL)-PIPERAZIN-1-YL]-QUINOLINE AND CRYSTALLINE FORMS THEREOF Wyeth (US) 2009-02-25 EP claimed
EP-2027111-A2 6-METHOXY-8-[4-(1-(5-FLUORO)-QUINOLIN-8-YL-PIPERIDIN-4-YL)-PIPERAZIN-1-YL]-QUINOLINE HYDROCHLORIC ACID SALTS Wyeth (US) 2009-02-25 EP claimed
US-20080119481-A1 Crystalline forms of 6-methoxy-8-[4-(1-(5-fluoro)-quinolin-8-yl-piperidin-4-yl)-piperazin-1-yl]-quinoline WYETH (US) 2008-05-22 US claimed
US-20080045510-A1 Succinate salts of 6-methoxy-8-[4-(1-(5-fluoro)-quinolin-8-yl-piperidin-4-yl)-piperazin-1-yl]-quinoline and crystalline forms thereof WYETH (US) 2008-02-21 US claimed
US-20070299083-A1 6-Methoxy-8-[4-(1-(5-fluoro)-quinolin-8-yl-piperidin-4-yl)-piperazin-1-yl]-quinoline hydrochloric acid salts WYETH (US) 2007-12-27 US claimed
WO-2007146116-A2 CRYSTALLINE FORMS OF 6-METHOXY-8-[4-(1-(5-FLUORO)-QUINOLIN-8-YL-PIPERIDIN-4-YL)-PIPERAZIN-1-YL]-QUINOLINE WYETH (US) 2007-12-21 WO claimed
WO-2007146115-A2 6-METHOXY-8-[4-(1-(5-FLUORO)-QUINOLIN-8-YL-PIPERIDIN-4-YL)-PIPERAZIN-1-YL]-QUINOLINE HYDROCHLORIC ACID SALTS WYETH (US) 2007-12-21 WO claimed
WO-2007146202-A2 SUCCINATE SALTS OF 6-METHOXY-8-[4-(1-(5-FLUORO)-QUINOLIN-8-YL-PIPERIDIN-4-YL)-PIPERAZIN-1-YL]-QUINOLINE AND CRYSTALLINE FORMS THEREOF WYETH (US) 2007-12-21 WO claimed
US-7671056-B2 Piperazine-piperidine antagonists and agonists of the 5-HT1A receptor WYETH LLC (US) 2010-03-02 US disclosed
CN-101466701-A Crystalline forms of 6-methoxy-8-[4-(1-(5-fluoro)-quinolin-8-yl-piperidin-4-yl)-piperazin-1-yl]-quinoline WYETH CORP (US) 2009-06-24 CN disclosed
CN-101466701-A Crystalline forms of 6-methoxy-8-[4-(1-(5-fluoro)-quinolin-8-yl-piperidin-4-yl)-piperazin-1-yl]-quinoline WYETH CORP (US) 2009-06-24 CN disclosed
CN-101460486-A Succinate salts of 6-methoxy-8- [ 4- (1- (5-fluoro) -quinolin-8-yl-piperidin-4-yl) -piperazin-1-yl ] -quinoline and crystalline forms thereof WYETH CORP (US) 2009-06-17 CN disclosed
CN-101460486-A Succinate salts of 6-methoxy-8- [ 4- (1- (5-fluoro) -quinolin-8-yl-piperidin-4-yl) -piperazin-1-yl ] -quinoline and crystalline forms thereof WYETH CORP (US) 2009-06-17 CN disclosed
WO-2007146116-A2 CRYSTALLINE FORMS OF 6-METHOXY-8-[4-(1-(5-FLUORO)-QUINOLIN-8-YL-PIPERIDIN-4-YL)-PIPERAZIN-1-YL]-QUINOLINE WYETH (US) 2007-12-21 WO disclosed
WO-2007146116-A2 CRYSTALLINE FORMS OF 6-METHOXY-8-[4-(1-(5-FLUORO)-QUINOLIN-8-YL-PIPERIDIN-4-YL)-PIPERAZIN-1-YL]-QUINOLINE WYETH (US) 2007-12-21 WO disclosed
WO-2007146115-A2 6-METHOXY-8-[4-(1-(5-FLUORO)-QUINOLIN-8-YL-PIPERIDIN-4-YL)-PIPERAZIN-1-YL]-QUINOLINE HYDROCHLORIC ACID SALTS WYETH (US) 2007-12-21 WO disclosed
WO-2007146116-A2 CRYSTALLINE FORMS OF 6-METHOXY-8-[4-(1-(5-FLUORO)-QUINOLIN-8-YL-PIPERIDIN-4-YL)-PIPERAZIN-1-YL]-QUINOLINE WYETH (US) 2007-12-21 WO disclosed
US-20070027160-A1 5-fluoro-8-(4-(4-(6-methoxyquinolin-8-yl)piperazin-1-yl)piperidin-1-yl)quinoline; central nervous system disorders, such as cognition disorders, anxiety disorders, depression and sexual dysfunction WYETH (US) 2007-02-01 US disclosed
WO-2006135839-A2 PIPERAZINE-PIPERIDINE ANTAGONISTS AND AGONISTS OF THE 5-HT1A RECEPTOR WYETH (US) 2006-12-21 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 (4 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-20070299083-A1 6-Methoxy-8-[4-(1-(5-fluoro)-quinolin-8-yl-piperidin-4-yl)-piperazin-1-yl]-quinoline hydrochloric acid salts HTR5A, HTR2C, HTR1A HTR1A 3/4885
US-20070027160-A1 5-fluoro-8-(4-(4-(6-methoxyquinolin-8-yl)piperazin-1-yl)piperidin-1-yl)quinoline; central nervous system disorders, such as cognition disorders, anxiety disorders, depression and sexual dysfunction HTR5A, HTR2C, HTR1D HTR1A 4/4885
US-20080045510-A1 Succinate salts of 6-methoxy-8-[4-(1-(5-fluoro)-quinolin-8-yl-piperidin-4-yl)-piperazin-1-yl]-quinoline and crystalline forms thereof HTR5A, SUCNR1, HTR2C HTR1A 4/4885
US-20080119481-A1 Crystalline forms of 6-methoxy-8-[4-(1-(5-fluoro)-quinolin-8-yl-piperidin-4-yl)-piperazin-1-yl]-quinoline HTR5A, HTR2C, HTR1A HTR1A 3/4885

“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.