SCHEMBL5853380

SCHEMBL5853380

CCC(C)(C#N)N=NC(C)(C#N)CC.COC(C)(C)CC(C)(C#N)N=NC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL295978 0.93 ALDH1A1 (0.32) ALDH1A1TSHRTDP1
SCHEMBL295979 0.93 ALDH1A1 (0.32) ALDH1A1TSHRTDP1
SCHEMBL9735634 0.93 ALDH1A1 (0.32) ALDH1A1TSHRTDP1
SCHEMBL22587 0.87 ALDH1A1 (0.36) ALDH1A1TSHRTDP1
SCHEMBL28649 0.87 ALDH1A1 (0.36) ALDH1A1TSHRTDP1
SCHEMBL297008 0.84
SCHEMBL297009 0.84
Hydrogen Peroxide SCHEMBL11530608 0.83 ALDH1A1 (0.33) ALDH1A1TSHRTDP1
SCHEMBL7065201 0.79
SCHEMBL16320228 0.79 ALDH1A1 (0.31) ALDH1A1TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7148288-B2 Process for formation of preformed stabilizer polyols BASF CORPORATION (US) 2006-12-12 US disclosed
US-6077456-A REACTION PRODUCT OF AN ORGANIC POLYISOCYANATE BLEND AND A POLYOXYPROPYLENE POLYOL BASF CORPORATION (US) 2000-06-20 US disclosed
US-5716439-A FOR POLYURETHANES BASF CORPORATION (US) 1998-02-10 US disclosed
US-5716548-A CONTAINING ISOCYANATE REACTIVE POLYOL; STRUCTURE REACTION INJECTION MOLDING BASF CORPORATION (US) 1998-02-10 US disclosed
US-5686526-A AROMATIC AMINE INITIATED POLYOL, POLYSILOXANE INTERNAL RELEASE AGENT, COMPOSITES BASF CORPORATION (US) 1997-11-11 US disclosed
US-5686187-A MIXTURE OF SILICONE AND AROMATIC DIESTER AS INTERNAL MOLD RELEASE AGENT BASF CORPORATION (US) 1997-11-11 US disclosed
US-5436276-A Odors and perfumes in polyurethanes INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1995-07-25 US disclosed
US-5177116-A Polysiloxane BASF CORPORATION (US) 1993-01-05 US disclosed
US-5149725-A Flexible polyurethane foams with reduced dripping during burning BASF CORPORATION (US) 1992-09-22 US disclosed
EP-0221412-B1 PROCESS FOR THE PREPARATION OF GRAFT POLYMER DISPERSIONS AND FLAME-RETARDANT POLYURETHANE FOAMS BASF Corporation (US) 1991-12-18 EP disclosed
EP-0297519-A1 Process for the preparation of integral skin polyurethane steering wheels BASF Corporation (US) 1989-01-04 EP disclosed
EP-0277487-A2 Storage stable polyisocyanates characterized by allophanate linkages BASF Corporation (US) 1988-08-10 EP disclosed
US-4738991-A CATALYTIC REACTION WITH ALCOHOL BASF CORPORATION (US) 1988-04-19 US disclosed
US-4689354-A STYRENE GRAFTED POLYESTERETHER POLYOLS, CHAIN TRANSFERAGENTS, UNSATURATION BASF CORPORATION (US) 1987-08-25 US disclosed
EP-0221412-A2 Process for the preparation of graft polymer dispersions and flame-retardant polyurethane foams BASF Corporation (US) 1987-05-13 EP disclosed
US-4568705-A HIGH RESILIENT POLYETHER-AND ESTERURETHANES BASF WYANDOTTE CORPORATION (US) 1986-02-04 US disclosed
US-4555527-A POLYURETHANE FOAM BASF WYANDOTTE CORPORATION (US) 1985-11-26 US disclosed
US-4522976-A Graft polymer dispersion in a mixture of low molecular weight polyols and polyether polyols and polyurethane foams prepared therefrom BASF WYANDOTTE CORPORATION (US) 1985-06-11 US disclosed
US-4458038-A ADDITION-CONDENSATION COPOLYMERS BASF WYANDOTTE CORPORATION (US) 1984-07-03 US disclosed
EP-0091036-A2 Process for the preparation of white graft polymer dispersions and flame-retardant polyurethane foams BASF Corporation (US) 1983-10-12 EP disclosed