SCHEMBL205065

SCHEMBL205065

C1CCCCC[N]CCCC1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 3/20 0.30
NOS1 P29475 3/20 0.30
NOS2 P35228 3/20 0.30

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
SCHEMBL194675 1.00
SCHEMBL687177 1.00 NOS3 (0.30) NOS3NOS1NOS2
SCHEMBL3273283 1.00 NOS3 (0.30) NOS3NOS1NOS2
SCHEMBL1823136 1.00 NOS3 (0.30) NOS3NOS1NOS2
SCHEMBL495581 1.00
SCHEMBL4294 1.00
SCHEMBL206353 1.00 NOS3 (0.30) NOS3NOS1NOS2
SCHEMBL6575355 1.00 NOS3 (0.30) NOS3NOS1NOS2
SCHEMBL9808297 1.00 NOS3 (0.30) NOS3NOS1NOS2
SCHEMBL1432 1.00

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1603929-B1 SOLUBLE GROUP-10 ALPHA-DIIMINE CATALYST PRECURSORS EXXONMOBIL CHEM PATENTS INC (US) 2007-08-01 EP claimed
US-7160834-B2 Soluble group-10 α-diimine catalyst precursors, catalysts and methods for dimerizing and oligomerizing olefins EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-01-09 US claimed
EP-1603929-A1 SOLUBLE GROUP-10 ALPHA-DIIMINE CATALYST PRECURSORS ExxonMobil Chemical Patents, Inc., A Corporation of the State of Delaware (US) 2005-12-14 EP claimed
WO-2004083224-A1 SOLUBLE GROUP-10 α-DIIMINE CATALYST PRECURSORS, EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-09-30 WO claimed
US-20040186010-A1 Soluble group-10 alpha-diimine catalyst precursors, catalysts and methods for dimerizing and oligomerizing olefins EXXONMOBIL CHEMICAL PATENTS INC. 2004-09-23 US claimed
EP-0103465-B1 20-AMINO MACROLIDE DERIVATIVES ELI LILLY AND COMPANY (US) 1986-09-10 EP claimed
EP-0058779-B1 CARBOXAMIDES, THEIR PREPARATION AND THEIR USE AS MEDICINES Dr. Karl Thomae GmbH (DE) 1984-09-19 EP claimed
EP-0103465-A1 20-Amino macrolide derivatives ELI LILLY AND COMPANY (US) 1984-03-21 EP claimed
EP-0023569-A1 Derivatives of carboxylic acids, their preparation and medicaments containing them Dr. Karl Thomae GmbH (DE) 1981-02-11 EP claimed
EP-2162435-B1 Ionic liquids as electrolytes INVISTA TECH SARL (CH) 2013-09-04 EP disclosed
EP-1854792-B1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2012-12-26 EP disclosed
US-20120190844-A1 IONIC LIQUIDS INVISTA NORTH AMERICA S.A R.L. (US) 2012-07-26 US disclosed
US-8088917-B2 Ionic liquids INVISTA NORTH AMERICA S.A R.L. (US) 2012-01-03 US disclosed
US-7820693-B2 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-10-26 US disclosed
EP-0058779-B1 CARBOXAMIDES, THEIR PREPARATION AND THEIR USE AS MEDICINES Dr. Karl Thomae GmbH (DE) 1984-09-19 EP disclosed
EP-0063826-A2 2-Amino-benzoic-acid derivatives, their preparation and their use as medicines or intermediates Dr. Karl Thomae GmbH (DE) 1982-11-03 EP disclosed
US-4353826-A ANTITUBERCULAR ANTIBIOTICS CIBA-GEIGY CORPORATION (US) 1982-10-12 US disclosed
EP-0058779-A2 Carboxamides, their preparation and their use as medicines Dr. Karl Thomae GmbH (DE) 1982-09-01 EP disclosed
US-4261891-A BACTERICIDES, ANTITUBERCULAR AGENTS CIBA-GEIGY CORPORATION (US) 1981-04-14 US disclosed
EP-0023569-A1 Derivatives of carboxylic acids, their preparation and medicaments containing them Dr. Karl Thomae GmbH (DE) 1981-02-11 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 (2 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-20120190844-A1 IONIC LIQUIDS INF2, H1-2, H1-0 NOS3 451/4885NOS1 514/4885NOS2 154/4885
US-20040186010-A1 Soluble group-10 alpha-diimine catalyst precursors, catalysts and methods for dimerizing and oligomerizing olefins OCIAD1, COG7, OCIAD2 NOS3 528/4885NOS1 288/4885NOS2 372/4885

“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.