SCHEMBL1787947

SCHEMBL1787947

C1=CNc2ccccc2C=C1.[N]

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46

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
SCHEMBL34259 0.98 GAA (0.48) GAAMAPT
Water SCHEMBL4672877 0.95 GAA (0.46) GAAMAPT
Ammonia Solution, Strong SCHEMBL4151802 0.95 GAA (0.46) GAAMAPT
SCHEMBL29181632 0.95 GAA (0.46) GAAMAPT
SCHEMBL8654087 0.95 GAA (0.46) GAAMAPT
Iodide SCHEMBL12466756 0.95 GAA (0.46) GAAMAPT
Hydrochloric Acid SCHEMBL160640 0.95 GAA (0.46) GAAMAPT
Water SCHEMBL16465946 0.95 GAA (0.46) GAAMAPT
Bromide SCHEMBL10654286 0.95 GAA (0.46) GAAMAPT
SCHEMBL8654084 0.95 GAA (0.46) GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9072749-B2 Treatment of age-related macular degeneration WEINSTOCK JOSEPH (US) 2015-07-07 US disclosed
EP-2222669-B1 OXADIAZOLE DERIVATIVES ACTIVE ON SPHINGOSINE-1-PHOSPHATE (SIP) GLAXO GROUP LTD (GB) 2013-08-21 EP disclosed
US-8222245-B2 Oxadiazole derivatives active on sphingosine-1-phosphate (S1P) GLAXO GROUP LIMITED (GB) 2012-07-17 US disclosed
EP-2326625-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HSTAMINE H3 ANTAGONISTS Takeda Pharmaceutical Company Limited (JP) 2011-06-01 EP disclosed
US-20110124626-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-05-26 US disclosed
US-20100316731-A1 TREATMENT OF AGE-RELATED MACULAR DEGENERATION WEINSTOCK JOSEPH 2010-12-16 US disclosed
US-20100273771-A1 OXADIAZOLE DERIVATIVES ACTIVE ON SPHINGOSINE-1-PHOSPHATE (SIP) GLAXO GROUP LIMITED (GB) 2010-10-28 US disclosed
EP-2222669-A1 OXADIAZOLE DERIVATIVES ACTIVE ON SPHINGOSINE-1-PHOSPHATE (SIP) Glaxo Group Limited (GB) 2010-09-01 EP disclosed
US-20100174065-A1 COMPOUNDS GLAXO GROUP LIMITED (US) 2010-07-08 US disclosed
EP-2170343-A1 TREATMENT OF AGE-RELATED MACULAR DEGENERATION Weinstock, Joseph (US) 2010-04-07 EP disclosed
EP-1646623-A2 5-H-BENZO[D]NAPHTH[2,1-B]AZEPINE DERIVATIVE AS SELECTIVE D1/D5 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF OBESITY AND CNS DISORDERS SCHERING CORPORATION (US) 2006-04-19 EP disclosed
WO-2005035504-A2 5-H -BENZO [D] NAPHTH [2, 1-B] AZEPINE DERIVATIVE AS SELECTIVE D1/D5 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF OBESITY AND CNS DISORDERS SCHERING CORPORATION (US) 2005-04-21 WO disclosed
US-20050075325-A1 Selective D1/D5 receptor antagonists for the treatment of obesity and CNS disorders SCHERING CORPORATION 2005-04-07 US disclosed
EP-0734398-B1 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2002-02-27 EP disclosed
US-5773512-A Compounds and methods SMITHKLINE BEECHAM CORP. (US) 1998-06-30 US disclosed
EP-0734398-A4 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 1997-04-16 EP disclosed
EP-0734398-A1 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 1996-10-02 EP disclosed
WO-1995016712-A1 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 1995-06-22 WO disclosed
EP-0238281-B1 SELECTIVE ALPHA-ADRENERGIC RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1990-05-16 EP disclosed
EP-0238281-A1 Selective alpha-adrenergic receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1987-09-23 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 (5 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-20110124626-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS HRH4, HRH3, HRH2 GAA 4339/4885MAPT 3598/4885
US-20100174065-A1 COMPOUNDS CYP11B2, CYP11B1, GLS2 GAA 83/4885MAPT 1092/4885
US-20050075325-A1 Selective D1/D5 receptor antagonists for the treatment of obesity and CNS disorders GPR119, DRD2, OPRL1 GAA 1019/4885MAPT 2707/4885
US-20100273771-A1 OXADIAZOLE DERIVATIVES ACTIVE ON SPHINGOSINE-1-PHOSPHATE (SIP) S1PR3, S1PR1, S1PR2 GAA 650/4885MAPT 1926/4885
US-20100316731-A1 TREATMENT OF AGE-RELATED MACULAR DEGENERATION AGER, ALDH1A2, PDE6D GAA 1105/4885MAPT 902/4885

“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.