SCHEMBL6607938

SCHEMBL6607938

COc1cc(NCCC(N)=O)nc2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.62
ALOX15 P16050 1/20 0.52
ACHE P22303 5/20 0.48
APP P05067 3/20 0.46
P2RY12 Q9H244 3/20 0.46
KDM4E B2RXH2 3/20 0.46
LMNA P02545 1/20 0.45
HPGD P15428 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MAPT P10636 4/20 0.44
POLB P06746 2/20 0.44
PDE10A Q9Y233 1/20 0.44
GAA P10253 2/20 0.44
MAPK1 P28482 1/20 0.44
RAB9A P51151 1/20 0.44
TTR P02766 1/20 0.44
GLA P06280 1/20 0.44
RAD52 P43351 1/20 0.44
TOP2A P11388 1/20 0.43

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
SCHEMBL6607915 0.81 SLC2A1 (0.62) SLC2A1ALOX15APPKDM4ELMNA
SCHEMBL6606672 0.81 SLC2A1 (0.70) SLC2A1ALOX15ACHEAPPP2RY12
SCHEMBL7812693 0.80 SLC2A1 (0.61) SLC2A1ALOX15ACHEKDM4ELMNA
Hydrochloric Acid SCHEMBL6607447 0.80 SLC2A1 (0.61) SLC2A1ALOX15APPKDM4ELMNA
SCHEMBL7805481 0.79 SLC2A1 (0.60) SLC2A1ACHEKDM4ELMNAHPGD
SCHEMBL6607801 0.77 SLC2A1 (0.64) SLC2A1ALOX15ACHEAPPP2RY12
SCHEMBL6606773 0.77 SLC2A1 (0.71) SLC2A1ALOX15P2RY12KDM4ELMNA
SCHEMBL6607445 0.76 SLC2A1 (0.54) SLC2A1ALOX15ACHEAPPP2RY12
SCHEMBL6607969 0.76 SLC2A1 (0.57) SLC2A1ALOX15
SCHEMBL5667848 0.76 SLC2A1 (0.54) SLC2A1ALOX15GAARAB9A

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-6818655-B2 2-AMINOQUINOLINES; CARDIOVASCULAR, GASTROINTESTINAL, PYSCHOLOGICAL, RESPIRATORY AND NERVOUS SYSTEM DISORDERS SMITHKLINE BEECHAM CORPORATION 2004-11-16 US claimed
EP-1359915-A4 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM (US) 2004-07-21 EP claimed
US-20040063757-A1 Urotensin-ll receptor antagonists SMITHKLINEE BEECHAM CORPORATION 2004-04-01 US claimed
EP-1359915-A1 UROTENSIN-II RECEPTOR ANTAGONISTS Smithkline Beecham (US) 2003-11-12 EP claimed
WO-2002058702-A1 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (GB) 2002-08-01 WO claimed
US-6818655-B2 2-AMINOQUINOLINES; CARDIOVASCULAR, GASTROINTESTINAL, PYSCHOLOGICAL, RESPIRATORY AND NERVOUS SYSTEM DISORDERS SMITHKLINE BEECHAM CORPORATION 2004-11-16 US disclosed
EP-1359915-A4 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM (US) 2004-07-21 EP disclosed
US-20040063757-A1 Urotensin-ll receptor antagonists SMITHKLINEE BEECHAM CORPORATION 2004-04-01 US disclosed
EP-1359915-A1 UROTENSIN-II RECEPTOR ANTAGONISTS Smithkline Beecham (US) 2003-11-12 EP disclosed
WO-2002058702-A1 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (GB) 2002-08-01 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-20040063757-A1 Urotensin-ll receptor antagonists UTS2R, PLAUR, SCTR SLC2A1 3284/4885ALOX15 2175/4885ACHE 1244/4885

“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.