SCHEMBL8957753

SCHEMBL8957753

CCCCC(CC(=O)O)C(CC)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.48
MAPK1 P28482 1/20 0.48
GPR84 Q9NQS5 7/20 0.44
TDP1 Q9NUW8 2/20 0.43
CHRM1 P11229 1/20 0.40
AKR1A1 P14550 1/20 0.40
CHRM3 P20309 1/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
ADRA1A P35348 1/20 0.40
HRH1 P35367 1/20 0.40
DRD3 P35462 1/20 0.40
SLC6A3 Q01959 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
CA1 P00915 3/20 0.38
FFAR1 O14842 1/20 0.38
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38
SLC1A1 P43005 1/20 0.38

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
SCHEMBL6049840 0.88 TDP1 (0.48) CA2MAPK1GPR84TDP1CHRM1
SCHEMBL2577773 0.83 GPR84 (0.54) CA2MAPK1GPR84TDP1FFAR1
SCHEMBL27725183 0.83 GPR84 (0.56) CA2GPR84FFAR1MAPTLCK
SCHEMBL8356801 0.83 GPR84 (0.56) CA2GPR84FFAR1MAPTLCK
Butane SCHEMBL28899006 0.82 CA2 (0.50) CA2MAPK1GPR84TDP1CHRM1
SCHEMBL4347772 0.81 GPR84 (0.44) CA2MAPK1GPR84TDP1CHRM1
SCHEMBL997999 0.81 TDP1 (0.52) GPR84TDP1CHRM1AKR1A1CHRM3
SCHEMBL14761700 0.80 GPR84 (0.55) CA2MAPK1GPR84FFAR1MAPT
SCHEMBL27643509 0.80 GPR84 (0.50) CA2MAPK1GPR84TDP1CHRM1
SCHEMBL3042137 0.79 GPR84 (0.52) CA2MAPK1GPR84TDP1FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5512319-A COATING FABRIC WITH SILICONE SURFACTANT DISSOLVED IN WATER, EXPANDING POLYURETHANE FOAMING MIXTURE IN CONTACT WITH COATED FABRIC BASF CORPORATION (US) 1996-04-30 US disclosed
US-5338819-A Reacting polyisocyanate with low molecular weight polyol mixture in presence of catalyst in solvent in which product is insoluble, separating BASF CORPORATION (US) 1994-08-16 US disclosed
US-4762950-A ALKALIC METAL HYDROXIDE, PREPARATION OF POLYURETHANE-POLYUREAS BASF CORPORATION (US) 1988-08-09 US disclosed
US-4757095-A Polyurethane-polyurea composition comprising reaction product of a mixture of diphenylmethane diisocyanate and uretonimine modified diisocyanate, polyol, with a lactone and a lactam, an alkane diol, and catalyst BASF CORPORATION (US) 1988-07-12 US disclosed
US-4596685-A Reacting polyisocyanate, polyols, and oxyethylated amine BASF CORPORATION (US) 1986-06-24 US disclosed
US-4590225-A Polyurethane products based on alkylene oxide adducts of aniline having reduced viscosity BASF CORPORATION (US) 1986-05-20 US disclosed
US-4562290-A RIGID POLYURETHANE FOAMS, LOW VISCOSITY BASF WYANDOTTE CORPORATION (US) 1985-12-31 US disclosed
US-4536557-A IN SITU POLYMERIZATION OF ETHYLENICALLY UNSATURATED MONOMER AND CHAIN EXTENDER WITH FREE RADICAL CATLYST AND POLYVINYLPYRROLIDONE STA BASF WYANDOTTE CORPORATION (US) 1985-08-20 US disclosed
US-4529746-A Alkylated vicinal toluenediamines and their use as chain extenders in the preparation of polyurethane-polyurea elastomers BASF WYANDOTTE CORPORATION (US) 1985-07-16 US disclosed
US-4517383-A FOR POLYURETHANES AND NONIONIC SURFACTANTS BASF WYANDOTTE CORPORATION (US) 1985-05-14 US disclosed
US-4353955-A COATING A FABRIC WITH A SILICONE SURFACTANT BEFORE EXPANDING POLYURETHANE MIXTURE BASF WYANDOTTE CORPORATION (US) 1982-10-12 US disclosed
US-4349638-A Process for the preparation of foams characterized by isocyanurate, and/or urethane linkages involving the use of alkali metal ammonium carboxylate catalysts BASF WYANDOTTE CORPORATION (US) 1982-09-14 US disclosed
US-4347330-A OPEN-CELL POLYURETHANE FOAM; POLYSILOXANE-POLYOXYALKYLENE, POLYMETHYLSILOXANE, POLYOXYETHYLENE POLYETHER CELL MODIFIERS BASF WYANDOTTE CORPORATION (US) 1982-08-31 US disclosed
EP-0056583-A1 Polyisocyanurate polymer dispersions, and cellular and non-cellular polyurethane products prepared therefrom BASF Corporation (US) 1982-07-28 EP disclosed
EP-0056581-A1 Process for the preparation of polyisocyanurate dispersions and compositions prepared therefrom BASF WYANDOTTE CORPORATION (US) 1982-07-28 EP disclosed
US-4326043-A FIREPROOFING BASF WYANDOTTE CORPORATION (US) 1982-04-20 US disclosed
US-4324867-A FROM A POLYETHER, ISOCYANATE, DIAMINODIPHENYLALKANE MIXTURE BASF WYANDOTTE CORPORATION (US) 1982-04-13 US disclosed
EP-0045413-A1 Flexible polyurethane foam compositions and methods for the preparation BASF WYANDOTTE CORPORATION (US) 1982-02-10 EP disclosed
US-4210728-A Preparation of high resiliency polyurethane foams BASF WYANDOTTE CORPORATION (US) 1980-07-01 US disclosed
EP-0003954-A1 Reactive polyol compositions and high resiliency polyurethane foams obtained by using these compositions BASF WYANDOTTE CORPORATION (US) 1979-09-19 EP disclosed