SCHEMBL5137302

SCHEMBL5137302

O=c1cc[c]nn1CCCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 3/20 0.46
GSK3B P49841 3/20 0.46
PDE4A P27815 3/20 0.43
PDE4B Q07343 3/20 0.43
PDE4C Q08493 3/20 0.43
PDE4D Q08499 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
SIGMAR1 Q99720 1/20 0.42
MGLL Q99685 2/20 0.41
FAAH O00519 1/20 0.41
ALDH1A1 P00352 1/20 0.40
ALDH2 P05091 1/20 0.40
PKM P14618 1/20 0.40
ALDH3A1 P30838 1/20 0.40
DAO P14920 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL102010 0.80 ALDH1A1 (0.45) GSK3AGSK3BPDE4APDE4BPDE4C
SCHEMBL957666 0.69
SCHEMBL12597287 0.67 GSK3A (0.47) GSK3AGSK3BPDE4APDE4BPDE4C
SCHEMBL18462236 0.67 DAO (0.48) GSK3AGSK3BPDE4APDE4BPDE4C
SCHEMBL3380286 0.64 GSK3A (1.00) GSK3AGSK3BL3MBTL1SIGMAR1MGLL
SCHEMBL30371663 0.62 TDP1 (0.86) GSK3AGSK3BL3MBTL1ALDH1A1ALDH2
SCHEMBL40501 0.62 GSK3A (0.65) GSK3AGSK3BL3MBTL1SIGMAR1MGLL
SCHEMBL45050 0.62 TDP1 (0.86) GSK3AGSK3BL3MBTL1ALDH1A1ALDH2
SCHEMBL1491103 0.62 ALDH1A1 (0.49) GSK3AGSK3BSIGMAR1ALDH1A1PKM
SCHEMBL10494043 0.62 SIGMAR1 (0.46) GSK3AGSK3BSIGMAR1

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
US-20110319349-A1 Methods for Reducing Platelet Activation and for the Treatment of Thrombotic Events SCOTT ROBERT A D (US) 2011-12-29 US disclosed
EP-1931355-A2 METHODS FOR REDUCING PLATELET ACTIVATION AND FOR THE TREATMENT OF THROMBOTIC EVENTS Atherogenics, Inc. (US) 2008-06-18 EP disclosed
US-20070213303-A1 Methods for reducing platelet activation and for the treatment of thrombotic events CRABTREE ACQUISITION CO, LLC 2007-09-13 US disclosed
WO-2007044726-A2 METHODS FOR REDUCING PLATELET ACTIVATION AND FOR THE TREATMENT OF THROMBOTIC EVENTS ATHEROGENICS, INC. (US) 2007-04-19 WO disclosed
EP-1446113-A4 COMPOUNDS AND METHODS FOR TREATING TRANSPLANT REJECTION ATHEROGENICS INC (US) 2006-12-06 EP disclosed
EP-1634888-A2 Synthesis of 2'-deoxy-L-nucleosides Pharmasset Limited (US) 2006-03-15 EP disclosed
EP-1600451-A2 Synthesis of 2'-deoxy-l-nucleosides Pharmasset Limited (US) 2005-11-30 EP disclosed
EP-1600452-A2 Synthesis of 2'-deoxy-L-nucleosides Pharmasset Limited (US) 2005-11-30 EP disclosed
US-20050090660-A1 2'-deoxy-L-nucleosides PHARMASSET, INC. 2005-04-28 US disclosed
EP-1446113-A2 COMPOUNDS AND METHODS FOR TREATING TRANSPLANT REJECTION Atherogenics, Inc. (US) 2004-08-18 EP disclosed
US-5684029-A HYPOTENSIVE AGENTS KARL THOMAE GMBH (DE) 1997-11-04 US disclosed
EP-0468470-B1 Benzimidazoles, medicaments containing them and process for their preparation THOMAE GMBH DR K (DE) 1997-04-16 EP disclosed
US-5614519-A (1-(2,3 or 4-N-morpholinoalkyl)-imidazol-4-yl)-benizimidazol-1-yl-methyl]-biphenyls useful as angiotensin-II antagonists KARL THOMAE GMBH (DE) 1997-03-25 US disclosed
US-5602127-A ADMINISTERING TO TREAT HYPERTENSION KARL THOMAE GMBH (DE) 1997-02-11 US disclosed
US-5594003-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-14 US disclosed
US-5591762-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-07 US disclosed
US-5587393-A ANGIOTENSIN ANTAGONIST USEFUL IN TREATING HYPERTENSION DR. KARL THOMAE GMBH (DE) 1996-12-24 US disclosed
US-5385925-A Benzimidazoles, pharmaceutical compositions containing these compounds and processes for preparing them DR. KARL THOMAE GMBH (DE) 1995-01-31 US disclosed
EP-0502314-A1 Benzimidazol, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-09-09 EP disclosed
EP-0468470-A1 Benzimidazoles, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-01-29 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 (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-20050090660-A1 2'-deoxy-L-nucleosides CCNH, ADAR, NSUN2 GSK3A 782/4885GSK3B 704/4885PDE4A 2614/4885
US-20110319349-A1 Methods for Reducing Platelet Activation and for the Treatment of Thrombotic Events PLAT, F2, TFPI GSK3A 2284/4885GSK3B 2369/4885PDE4A 594/4885
US-20070213303-A1 Methods for reducing platelet activation and for the treatment of thrombotic events PLAT, F2, TFPI GSK3A 2284/4885GSK3B 2369/4885PDE4A 594/4885

“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.