SCHEMBL7758034

SCHEMBL7758034

COC(C)(CN=NCC(C)C)CC(C)C#N

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL1659729 0.92 TSHR (0.30)
SCHEMBL5172097 0.82
SCHEMBL10508307 0.80
SCHEMBL11696268 0.78
SCHEMBL10699351 0.74 PPARA (0.33)
SCHEMBL4476401 0.70 TSHR (0.39)
SCHEMBL225684 0.68 TSHR (0.38)
Methyl Alcohol SCHEMBL21625742 0.65 TSHR (0.35)
SCHEMBL9767943 0.65 TSHR (0.31)
SCHEMBL7745657 0.64 TSHR (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0664306-B1 A graft polymer dispersion having a third monomer and polyurethane foams having a reduced tendency to shrink once prepared thereby BASF CORP (US) 2001-05-02 EP disclosed
US-6028122-A Energy absorbing, water blown, rigid polyurethane foam BASF CORPORATION (US) 2000-02-22 US disclosed
US-5919972-A STABILITY; LOW VISCOSITY BASF CORPORATION (US) 1999-07-06 US disclosed
US-5872193-A PRODUCT OF DIPHENYLMETHANE DIISOCYANATE AND HIGH MOLECULAR WEIGHT ACTIVE HYDROGEN CONTAINING COMPOUND IN DILUENT; POLYETHERURETHANE COPOLYMERS; STORAGE STABILITY, LOW VISCOSITY BASF CORPORATION (US) 1999-02-16 US disclosed
US-5863959-A WATER BLOWN MOLDED POLYETHERURETHANE CONTAINING UNSATURATED MOMOMERS COMPRISING ACRYLONITRILE, STYRENE OR METHYLSTYRENE/4-/, AND HYDROXY FUNCTIONAL C2 TO C6 ALKYL METHACRYLATE; STABILITY, LOW VISCOSITY BASF CORPORATION (US) 1999-01-26 US disclosed
EP-0572833-B1 Energy absorbing, water blown, rigid polyurethane foam and methods of preparing same BASF CORP (US) 1998-08-05 EP disclosed
US-5741851-A Graft polymer dispersion having a third monomer and polyurethane foams having a reduced tendency to shrink prepared thereby BASF CORPORATION (US) 1998-04-21 US disclosed
US-5672632-A POLYURETHANE AND/OR POLYETHERURETHANE COPOLYMER WATER-BLOWN FOAMS HAVING CONTROLLED TENSILE STRENGTH AND WEAR RESISTANCE, FOR SHOE SOLES BASF CORPORATION (US) 1997-09-30 US disclosed
US-5658959-A TENSILE STRENGTH; SHOE SOLES BASF CORPORATION (US) 1997-08-19 US disclosed
EP-0771829-A1 Process of making an integral skin polyurethane article BASF CORPORATION (US) 1997-05-07 EP disclosed
US-4337296-A FREE RADICAL POLYMERIZATION AT INTERFACE OF SUPERIMPOSED LAYERS CONGOLEUM CORPORATION (US) 1982-06-29 US disclosed
US-4263417-A ALLYL-VINYL COPOLYMER PENNWALT CORPORATION (US) 1981-04-21 US disclosed
US-4248922-A BY CONTROLLED PLACEMENT OF A CATALYST, APPLYING A REACTIVE POLYMERIZABLE MONOMER, HEAT TREATING TO SELECTIVELY POLYMERIZE THE MONOMER CONGOLEUM CORPORATION (US) 1981-02-03 US disclosed
US-4217385-A Resinous polymer sheet materials having selective, surface decorative effects and methods of making the same CONGOLEUM CORPORATION (US) 1980-08-12 US disclosed
US-4217433-A Diethylene glycol bis(allyl carbonate) compositions containing crosslinkable copolymers PENNWALT CORPORATION (US) 1980-08-12 US disclosed
US-4214028-A Resinous polymer sheet materials having surface decorative effects and methods of making the same CONGOLEUM CORPORATION (US) 1980-07-22 US disclosed
US-4187131-A Resinous polymer sheet materials having selective, surface decorative effects and methods of making the same CONGOLEUM CORPORATION (US) 1980-02-05 US disclosed
EP-0003965-A1 Resinous polymer sheet materials having selective, surface decorative effects and methods of making the same Congoleum Corporation (US) 1979-09-19 EP disclosed
US-4158672-A OIL AND WATER REPELLENTS FOR TEXTILES CIBA-GEIGY CORPORATION (US) 1979-06-19 US disclosed
US-4026828-A BLOWING AGENTS ROHM AND HAAS COMPANY (US) 1977-05-31 US disclosed