SCHEMBL8984940

SCHEMBL8984940

CCCCOC(=O)C(CC)(CCCC)O[O]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
ATM Q13315 1/20 0.41
TSHR P16473 5/20 0.39
HPGD P15428 1/20 0.39
HCAR2 Q8TDS4 1/20 0.37
NAAA Q02083 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
POLB P06746 1/20 0.36
EPHX1 P07099 1/20 0.34
ESR1 P03372 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAPK1 P28482 1/20 0.34
CYP2C19 P33261 1/20 0.34
NR1H2 P55055 1/20 0.34
RNASEL Q05823 1/20 0.34
ACHE P22303 2/20 0.33

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
SCHEMBL27415357 0.79 ALDH1A1 (0.48) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL717671 0.79 DGAT1 (0.34)
SCHEMBL315632 0.77
SCHEMBL1487153 0.77 PAM (0.33) ALDH1A1TSHRTDP1ESR1
SCHEMBL6251425 0.76 MAPT (0.35)
SCHEMBL27490417 0.76 ALDH1A1 (0.48) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL28778154 0.76 CYP4F2 (0.55) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL29149655 0.76 CYP4F2 (0.50) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL597342 0.75 ALDH1A1 (0.52) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL2276500 0.75 ALDH1A1 (0.52) ALDH1A1ATMTSHRHPGDHCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0470674-B1 Epoxy resin composition SHELL INT RESEARCH (NL) 1996-05-22 EP disclosed
US-5300603-A Forms polymers with superior toughness, high glass transition temperature; composites SHELL OIL COMPANY (US) 1994-04-05 US disclosed
US-5250643-A Form copolymers with superior toughness, melt processability SHELL OIL COMPANY (US) 1993-10-05 US disclosed
US-5169910-A Curable epoxy resin; reactive diluent; epoxy curing agent; stable isocyanate; product has good high temperature properties SHELL OIL COMPANY (US) 1992-12-08 US disclosed
EP-0470674-A2 Epoxy resin composition SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1992-02-12 EP disclosed
EP-0190021-B1 HEAT-FOAMABLE CROSSLINKED PROPYLENE RESIN COMPOSITION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-09-11 EP disclosed
US-4916165-A Heat-foamable crosslinked propylene resin composition in the form of a melt-shaped sheet structure MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1990-04-10 US disclosed
US-4870114-A HEAT RESISTANCE, STRENGTH, RIGIDITY MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-09-26 US disclosed
EP-0268240-A2 Unsaturated copolymer resin composite MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1988-05-25 EP disclosed
US-4654383-A CONTAINING HALOGENATED STYRENE MONOMER SHELL OIL COMPANY (US) 1987-03-31 US disclosed
EP-0190021-A2 Heat-foamable crosslinked propylene resin composition MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1986-08-06 EP disclosed