SCHEMBL3016331

SCHEMBL3016331

[CH2]C1CCN(CCCC)CC1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 8/20 0.55
GNAI3 P08754 7/20 0.55
GNAI1 P63096 7/20 0.55
GLB1 P16278 1/20 0.42
KCNH2 Q12809 2/20 0.41
EPHX1 P07099 1/20 0.39
EPHX2 P34913 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
SCHEMBL8323260 0.93 GNAO1 (0.63) GNAO1GNAI3GNAI1KCNH2
SCHEMBL8321108 0.91 GNAO1 (0.67) GNAO1GNAI3GNAI1KCNH2
SCHEMBL8324108 0.91 GNAO1 (0.67) GNAO1GNAI3GNAI1KCNH2
SCHEMBL8322736 0.91 GNAO1 (0.67) GNAO1GNAI3GNAI1KCNH2
SCHEMBL8322298 0.91 GNAO1 (0.67) GNAO1GNAI3GNAI1KCNH2
SCHEMBL8325799 0.91 GNAO1 (0.67) GNAO1GNAI3GNAI1KCNH2
SCHEMBL8318615 0.91 GNAO1 (0.67) GNAO1GNAI3GNAI1KCNH2
SCHEMBL8323545 0.91 GNAO1 (0.67) GNAO1GNAI3GNAI1KCNH2
SCHEMBL8324635 0.86 DRD2 (0.47) GNAO1GNAI3GNAI1
SCHEMBL17212830 0.80 GNAO1 (0.63) GNAO1GNAI3GNAI1GLB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1503764-B1 5-HT4 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF HEART FAILURE SERODUS AS (NO) 2010-01-06 EP claimed
EP-1503764-A1 5-HT4 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF HEART FAILURE MEDINNOVA AS (NO) 2005-02-09 EP claimed
WO-2003097065-A1 5-HT4 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF HEART FAILURE MEDINNOVA AS (NO) 2003-11-27 WO claimed
US-5705509-A Tricyclic heterocyclic compounds as 5-HT4 receptor antagonists SMITHKLINE BEECHAM PLC (GB) 1998-01-06 US claimed
EP-0681583-B1 TRICYCLIC HETEROCYCLIC COMPOUNDS AS 5-HT4 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1997-10-22 EP claimed
EP-0664806-A1 HETEROCYCLIC CONDENSED BENZOIC ACID DERIVATIVES AS 5-HT 4? RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1995-08-02 EP claimed
EP-0662959-A1 5-HT4 ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1995-07-19 EP claimed
WO-1994008995-A1 HETEROCYCLIC CONDENSED BENZOIC ACID DERIVATIVES AS 5-HT4 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1994-04-28 WO claimed
CN-101297807-A The use of 5-HT4 receptor antagonists in the prophylaxis or treatment of certain cardiovascular conditions GLAXOSMITHKLINE LAB SAS (FR) 2008-11-05 CN disclosed
CN-100413539-C Use of 5-HT 4 receptor antagonists for the treatment of electrophysiological atrial remodelling GLAXOSMITHKLINE LAB SAS (FR) 2008-08-27 CN disclosed
US-20080125422-A1 USE OF 5HT4 RECEPTOR ANTAGONISTS IN THE PROPHYLAXIS OR TREATMENT OF CERTAIN CARDIOVASCULAR CONDITIONS LABORATOIRE GLAXOSMITHKLINE S A S 2008-05-29 US disclosed
EP-0812321-B1 PROKINETIC OXADIAZOLES JANSSEN PHARMACEUTICA NV (BE) 2008-01-23 EP disclosed
US-20070015769-A1 USE OF 5HT4 RECEPTOR ANTAGONISTS IN THE PROPHYLAXIS OR TREATMENT OF CERTAIN CARDIOVASCULAR CONDITIONS LABORATOIRE GLAXOSMITHKLINE S.A.S. 2007-01-18 US disclosed
US-20050032866-A1 The use of 5ht4 receptor antagonists in the prophylaxis or treatment of certain cardiovascular conditions GLAXO GROUP LIMITED (GB) 2005-02-10 US disclosed
CN-1040436-C Pharmaceuticals SMITHKLINE BEECHAM PLC (GB) 1998-10-28 CN disclosed
US-5705509-A Tricyclic heterocyclic compounds as 5-HT4 receptor antagonists SMITHKLINE BEECHAM PLC (GB) 1998-01-06 US disclosed
US-5580885-A FOR TREATMENT OF GASTROINTESTINAL, CARDIOVASCULAR OR NERVOUS SYSTEM DISORDERS SMITHKLINE BEECHAM P.L.C. (GB) 1996-12-03 US disclosed
EP-0629198-A1 NITROGEN CONTAINING HETEROCYCLIC COMPOUNDS USEFUL AS PHARMACEUTICALS SMITHKLINE BEECHAM PLC (GB) 1994-12-21 EP disclosed
WO-1993018027-A1 NITROGEN CONTAINING HETEROCYCLIC COMPOUNDS USEFUL AS PHARMACEUTICALS SMITHKLINE BEECHAM PLC (GB) 1993-09-16 WO disclosed
CN-1073173-A Preparation method as the compound of 5-hydroxytryptamine receptor antagonist SMITHKLINE BEECHAM PLC (GB) 1993-06-16 CN 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 (3 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-20080125422-A1 USE OF 5HT4 RECEPTOR ANTAGONISTS IN THE PROPHYLAXIS OR TREATMENT OF CERTAIN CARDIOVASCULAR CONDITIONS HTR4, TPH1, HTR1A GNAO1 779/4885GNAI3 990/4885GNAI1 1290/4885
US-20050032866-A1 The use of 5ht4 receptor antagonists in the prophylaxis or treatment of certain cardiovascular conditions HTR4, HTR1A, TPH1 GNAO1 899/4885GNAI3 1166/4885GNAI1 1348/4885
US-20070015769-A1 USE OF 5HT4 RECEPTOR ANTAGONISTS IN THE PROPHYLAXIS OR TREATMENT OF CERTAIN CARDIOVASCULAR CONDITIONS HTR4, HTR1A, TPH1 GNAO1 768/4885GNAI3 995/4885GNAI1 1269/4885

“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.