SCHEMBL8850849

SCHEMBL8850849

O=C1CCCCC(=O)OCC2CCC(CC2)CO1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.50
CYP2D6 P10635 2/20 0.50
CA9 Q16790 2/20 0.50
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C19 P33261 3/20 0.37
CYP3A4 P08684 2/20 0.37
CASP1 P29466 1/20 0.37
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
SLC6A3 Q01959 9/20 0.31
SLC6A4 P31645 6/20 0.31
SLC6A2 P23975 5/20 0.31
MEN1 O00255 1/20 0.31
ALOX15 P16050 1/20 0.31
KMT2A Q03164 1/20 0.31
TRIM24 O15164 1/20 0.30
TRIM33 Q9UPN9 1/20 0.30

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
SCHEMBL10783951 0.98 CYP2D6 (0.48) CA1CYP2D6CA9ALDH1A1LMNA
SCHEMBL4787647 0.98 CYP2D6 (0.48) CA1CYP2D6CA9ALDH1A1LMNA
SCHEMBL5330024 0.98 CYP2D6 (0.48) CA1CYP2D6CA9ALDH1A1LMNA
SCHEMBL4788382 0.98 CYP2D6 (0.48) CA1CYP2D6CA9ALDH1A1LMNA
SCHEMBL4788659 0.95 CYP2D6 (0.50) CA1CYP2D6CA9ALDH1A1LMNA
SCHEMBL6337539 0.90 TSHR (0.45) CA1CYP2D6CA9ALDH1A1LMNA
SCHEMBL6343324 0.90 TSHR (0.45) CA1CYP2D6CA9ALDH1A1LMNA
SCHEMBL3032192 0.90 TSHR (0.45) CA1CYP2D6CA9ALDH1A1LMNA
SCHEMBL625965 0.79 CYP2D6 (0.38) CA1CYP2D6CA9ALDH1A1LMNA
SCHEMBL9418314 0.78 CA1 (0.48) CA1CYP2D6CA9ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0624179-B1 MOLDING COMPOSITION BASED ON POLY(1,4-CYCLOHEXYLENE DIMETHYLENE TEREPHTHALATE) CONTAINING A HIGH MOLECULAR WEIGHT ALIPHATIC POLYESTER EASTMAN CHEM CO (US) 1997-04-02 EP claimed
US-5242967-A REINFORCED MOLDING COMPOSITION BASED ON POLY(1,4-CYCLOHEXYLENE DIMETHYLENE TEREPHTHALATE) CONTAINING A HIGH MOLECULAR WEIGHT ALIPHATIC POLYESTER EASTMAN KODAK COMPANY (US) 1993-09-07 US claimed
EP-0624179-B1 MOLDING COMPOSITION BASED ON POLY(1,4-CYCLOHEXYLENE DIMETHYLENE TEREPHTHALATE) CONTAINING A HIGH MOLECULAR WEIGHT ALIPHATIC POLYESTER EASTMAN CHEM CO (US) 1997-04-02 EP disclosed
US-5420212-A Polyester/polycarbonate/polycaprolactone blends EASTMAN CHEMICAL COMPANY (US) 1995-05-30 US disclosed
EP-0624179-A1 REINFORCED MOLDING COMPOSITION BASED ON POLY(1,4-CYCLOHEXYLENE DIMETHYLENE TEREPHTHALATE) CONTAINING A HIGH MOLECULAR WEIGHT ALIPHATIC POLYESTER. EASTMAN CHEM CO (US) 1994-11-17 EP disclosed
US-5242967-A REINFORCED MOLDING COMPOSITION BASED ON POLY(1,4-CYCLOHEXYLENE DIMETHYLENE TEREPHTHALATE) CONTAINING A HIGH MOLECULAR WEIGHT ALIPHATIC POLYESTER EASTMAN KODAK COMPANY (US) 1993-09-07 US disclosed
WO-1993015148-A1 REINFORCED MOLDING COMPOSITION BASED ON POLY(1,4-CYCLOHEXYLENE DIMETHYLENE TEREPHTHALATE) CONTAINING A HIGH MOLECULAR WEIGHT ALIPHATIC POLYESTER EASTMAN CHEMICAL COMPANY (US) 1993-08-05 WO disclosed
US-4576997-A Adhesive blends EASTMAN KODAK COMPANY (US) 1986-03-18 US disclosed
US-4551521-A Low-melting copolyester adhesives EASTMAN KODAK COMPANY (US) 1985-11-05 US disclosed
US-4240974-A 1,2,3,4,9,9-HEXAHALO-1,4-DIHYDRO-1,4-METHANO-NAPHTHALENE-5,8 -DISULFONATE LITTLE JULIAN R (US) 1980-12-23 US disclosed
US-4174457-A Carbamate UNIROYAL, INC. (US) 1979-11-13 US disclosed
US-4080408-A FIRE RETARDANTS UNIROYAL, INC. (US) 1978-03-21 US disclosed
US-4058568-A FIRE RETARDANT UNIROYAL, INC. (US) 1977-11-15 US disclosed
US-4009200-A FIREPROOFING POLYMERS UNIROYAL, INC. (US) 1977-02-22 US disclosed
US-3977050-A Fastener assembly MONARCH MARKING SYSTEMS, INC. (US) 1976-08-31 US disclosed
US-3965055-A Free curing rubber composition UNIROYAL INC. (US) 1976-06-22 US disclosed