SCHEMBL5590749

SCHEMBL5590749

C#CCCOC(=O)/C=C\C(=O)OCCC#C

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.48
ATM Q13315 1/20 0.46
HCAR2 Q8TDS4 6/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
ZDHHC20 Q5W0Z9 1/20 0.37
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TSHR P16473 3/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 1/20 0.33
TP53 P04637 1/20 0.33
HIF1A Q16665 1/20 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
SCHEMBL5590750 1.00 ALOX5 (0.48) ALOX5ATMHCAR2MEN1KMT2A
SCHEMBL8470292 0.92 HCAR2 (0.57) ALOX5ATMHCAR2MEN1KMT2A
SCHEMBL8470293 0.92 HCAR2 (0.57) ALOX5ATMHCAR2MEN1KMT2A
SCHEMBL14587452 0.92 TSHR (0.47) ALOX5ATMHCAR2MEN1KMT2A
SCHEMBL14587459 0.90 ALOX5 (0.43) ALOX5ATMHCAR2MEN1KMT2A
SCHEMBL14587457 0.90 HCAR2 (0.50) ALOX5ATMHCAR2MEN1KMT2A
SCHEMBL14619697 0.90 ALOX5 (0.49) ALOX5ATMHCAR2MEN1KMT2A
SCHEMBL8172894 0.87 MAPT (0.50) ALOX5ATMHCAR2MEN1KMT2A
SCHEMBL8172901 0.87 MAPT (0.50) ALOX5ATMHCAR2MEN1KMT2A
SCHEMBL14587446 0.85 ALOX5 (0.43) ALOX5ATMHCAR2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5516558-A SILICONE COATINGS FOR RELEASING FORMED BY MIXING ORGANOSILICON COMPOUNDS GENERAL ELECTRIC COMPANY (US) 1996-05-14 US claimed
EP-1845144-B1 Coated substrates having improved release characteristics MOMENTIVE PERFORMANCE MAT INC (US) 2012-12-19 EP disclosed
EP-1845144-A1 Coated substrates having improved release characteristics General Electric Company (US) 2007-10-17 EP disclosed
US-5932060-A BRANCHED ALKENYL SILICONE POLYMER COMPOSITIONS HAVING ON AVERAGE AT LEAST TWO BRANCHING POINTS PER MOLECULE GENERAL ELECTRIC COMPANY (US) 1999-08-03 US disclosed
EP-0903388-A2 Coated substrates having improved release characteristics GENERAL ELECTRIC COMPANY (US) 1999-03-24 EP disclosed
US-4134812-A BLENDING WITH TETRAKIS-(METHYLENE-(3,5-DI-T-BUTYL)-4-HYDROXY-HYDROCINNAMATE)-METHANE, CROSSLINKING WITH AN ACETYLENIC COMPOUND THE FURUKAWA ELECTRIC CO., LTD. (JP) 1979-01-16 US disclosed
US-4113595-A POLYOLEFIN, ACETYLENIC COMPOUND, SECONDARY AMINE JAPAN ATOMIC ENERGY RESEARCH INSTITUTE (JP) 1978-09-12 US disclosed