SCHEMBL5708662

SCHEMBL5708662

Cc1nc(CCc2nc(N)nc(N)n2)c[nH]1.O=c1[nH]c(=O)[nH]c(=O)[nH]1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CASP1 P29466 1/20 0.35
▸ TSHR P16473 1/20 0.33
▸ CYP1A2 P05177 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL415674 0.91 CASP1 (0.42) CASP1TSHRCYP1A2
SCHEMBL5983529 0.81 CASP1 (0.53) CASP1TSHRCYP1A2
SCHEMBL10725121 0.72 CASP1 (0.46) CASP1TSHRCYP1A2SMN1; SMN2
SCHEMBL5983208 0.72 CASP1 (0.39) CASP1TSHRCYP1A2SMN1; SMN2
SCHEMBL5885509 0.71 CYP1A2 (0.31) CASP1TSHRCYP1A2
SCHEMBL4973455 0.71 CTSK (0.35) —
SCHEMBL10730184 0.70 CASP1 (0.48) CASP1TSHRCYP1A2
SCHEMBL27553033 0.69 CASP1 (0.46) CASP1TSHRCYP1A2
SCHEMBL27576631 0.69 CASP1 (0.46) CASP1TSHRCYP1A2
SCHEMBL10727606 0.68 CASP1 (0.42) CASP1TSHRCYP1A2

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3331959-A1 ANIONIC CURABLE COMPOSITIONS Designer Molecules, Inc. (US) 2018-06-13 — — EP claimed
WO-2017027482-A1 ANIONIC CURABLE COMPOSITIONS DESIGNER MOLECULES, INC. (US) 2017-02-16 — — WO claimed
EP-3331959-A1 ANIONIC CURABLE COMPOSITIONS Designer Molecules, Inc. (US) 2018-06-13 — — EP disclosed
EP-3289033-A1 ADHESIVE FOR RUBBER BONDING LORD Corporation (US) 2018-03-07 — — EP disclosed
WO-2017027482-A1 ANIONIC CURABLE COMPOSITIONS DESIGNER MOLECULES, INC. (US) 2017-02-16 — — WO disclosed
WO-2016179010-A1 ADHESIVE FOR RUBBER BONDING LORD CORPORATION (US) 2016-11-10 — — WO disclosed
EP-1718447-A1 HEAT-CURABLE MOLDING MATERIAL PELLET HAVING MULTILAYER STRUCTURE 3M Innovative Properties Company (US) 2006-11-08 — — EP disclosed
WO-2005087472-A1 HEAT-CURABLE MOLDING MATERIAL PELLET HAVING MULTILAYER STRUCTURE 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-09-22 — — WO disclosed
EP-0993496-B1 ADHESIVE COMPOSITIONS WITH DURABILITY UNDER CONDITIONS OF HIGH HUMIDITY MINNESOTA MINING & MFG (US) 2004-04-28 — — EP disclosed
EP-0993496-A1 ADHESIVE COMPOSITIONS WITH DURABILITY UNDER CONDITIONS OF HIGH HUMIDITY MINNESOTA MINING AND MANUFACTURING COMPANY (US) 2000-04-19 — — EP disclosed
US-5883193-A INCLUDES AT LEAST ONE POLYMERIZABLE ACRYLIC OR METHACRYLIC ACID ESTER OF A NON-TERTIARY ALCOHOL, A THERMOSETTABLE EPOXY RESIN, AN AMINE CURATIVE, A SILANE COUPLING AGENT, AND A CHELATING AGENT MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-03-16 — — US disclosed
WO-1999001520-A1 ADHESIVE COMPOSITIONS WITH DURABILITY UNDER CONDITIONS OF HIGH HUMIDITY MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-01-14 — — WO disclosed
EP-0820491-A1 MELT-FLOWABLE MATERIALS AND METHOD OF SEALING SURFACES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-01-28 — — EP disclosed
WO-1996032453-A1 MELT-FLOWABLE MATERIALS AND METHOD OF SEALING SURFACES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-10-17 — — WO disclosed
EP-0729486-A1 MELT-FLOWABLE MATERIALS AND METHOD OF SEALING SURFACES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-09-04 — — EP disclosed
EP-0728165-A1 TOPOGRAPHICAL METHOD MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-08-28 — — EP disclosed
WO-1995013315-A1 MELT-FLOWABLE MATERIALS AND METHOD OF SEALING SURFACES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-05-18 — — WO disclosed
WO-1995013327-A1 TOPOGRAPHICAL METHOD MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-05-18 — — WO disclosed
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