SCHEMBL2170890

SCHEMBL2170890

Cc1cc(N=C=O)c(N=C=O)cc1C

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.56
TRPA1 O75762 1/20 0.56
TDP1 Q9NUW8 2/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
MAPK1 P28482 1/20 0.33
TSHR P16473 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
SCHEMBL375132 0.90 CYP3A4 (0.57) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL1191608 0.90 CYP3A4 (0.57) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL1044718 0.89 CYP3A4 (0.61) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL11334193 0.82 CYP3A4 (0.48) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL1045246 0.81 CYP3A4 (0.59) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL7746199 0.80 CYP3A4 (0.50) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL9694213 0.80 CYP3A4 (0.53) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL5576975 0.79 CYP3A4 (0.47) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL3843398 0.77 CYP3A4 (0.42) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL29648762 0.77 CYP3A4 (0.42) CYP3A4TRPA1TDP1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021079187-A1 MULTI(METH)ACRYLATE-FUNCTIONALIZED OLIGOMERS AND METHODS OF PREPARING AND USING SUCH OLIGOMERS ARKEMA FRANCE (FR) 2021-04-29 WO claimed
EP-1991608-A1 HIGHLY FILLED COMPOSITE MATERIALS Clausi, Robert N. (CA) 2008-11-19 EP claimed
WO-2007095730-A1 HIGHLY FILLED COMPOSITE MATERIALS CLAUSI ROBERT N (CA) 2007-08-30 WO claimed
EP-4720199-A1 SELF-CROSSLINKABLE URETHANE (METH)ACRYLATES ARKEMA France (FR) 2026-04-08 EP disclosed
WO-2024245621-A1 SELF-CROSSLINKABLE URETHANE (METH)ACRYLATES ARKEMA FRANCE (FR) 2024-12-05 WO disclosed
EP-4423158-A1 FLAME RETARDANT RIGID HIGH DENSITY POLYURETHANE FOAM Dow Quimica Mexicana S.A.de C.V. (MX) 2024-09-04 EP disclosed
WO-2023076139-A1 FLAME RETARDANT RIGID HIGH DENSITY POLYURETHANE FOAM DOW QUIMICA MEXICANA S.A.DE C.V. (MX) 2023-05-04 WO disclosed
EP-4048712-A1 MULTI(METH)ACRYLATE-FUNCTIONALIZED OLIGOMERS AND METHODS OF PREPARING AND USING SUCH OLIGOMERS ARKEMA FRANCE (FR) 2022-08-31 EP disclosed
EP-3864064-A1 A RIGID POLYURETHANE FOAM FORMULATION AND FOAM MADE THEREFROM Dow Global Technologies LLC (US) 2021-08-18 EP disclosed
EP-3864061-A1 A RIGID POLYURETHANE FOAM FORMULATION AND FOAM MADE THEREFROM Dow Global Technologies LLC (US) 2021-08-18 EP disclosed
WO-2021079187-A1 MULTI(METH)ACRYLATE-FUNCTIONALIZED OLIGOMERS AND METHODS OF PREPARING AND USING SUCH OLIGOMERS ARKEMA FRANCE (FR) 2021-04-29 WO disclosed
WO-1994006485-A1 MULTILAYER MATERIALS CIBA-GEIGY AG (CH) 1994-03-31 WO disclosed
EP-0530302-A1 COMPOSITION TO BE USED IN THE RESIN INJECTION MOULDING TECHNIQUE, CONTAINING LOW MOLECULAR WEIGHT COMPOUNDS JOINTLY FORMING A HYBRID NETWORK. DSM NV (NL) 1993-03-10 EP disclosed
WO-1992001009-A1 COMPOSITION CONTAINING ALKANOLAMINES AND POLYISOCYANATES DSM N.V. (NL) 1992-01-23 WO disclosed
WO-1991018033-A1 COMPOSITION TO BE USED IN THE RESIN INJECTION MOULDING TECHNIQUE, CONTAINING LOW MOLECULAR WEIGHT COMPOUNDS JOINTLY FORMING A HYBRID NETWORK DSM N.V. (NL) 1991-11-28 WO disclosed
EP-0244539-A1 Thermally stable polyurethane elastomers containing glycoside polyols and a method of producing them OLIN CORPORATION (US) 1987-11-11 EP disclosed
EP-0123912-A1 Blends of cyclic vinyl ether containing compounds and epoxides UNION CARBIDE CORPORATION (US) 1984-11-07 EP disclosed
EP-0119349-A2 Preparation of carboxylic acid-containing monoether or polyether polyol addition products, and polyurethane prepolymers derived therefrom OLIN CORPORATION (US) 1984-09-26 EP disclosed
EP-0102312-A1 Unsaturated polyurethanes THE GOODYEAR TIRE & RUBBER COMPANY (US) 1984-03-07 EP disclosed
EP-0048984-A2 Use of organosiloxane compositions as foam stabilizers in flexible polyester polyurethane foam UNION CARBIDE CORPORATION (US) 1982-04-07 EP disclosed