SCHEMBL9360976

SCHEMBL9360976

CC(C#N)OC(=O)CCCC(=O)OC(C)C#N

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.44
TSHR P16473 2/20 0.41
MAPT P10636 3/20 0.37
MAPK1 P28482 2/20 0.37
ALDH1A1 P00352 2/20 0.35
PRKCA P17252 1/20 0.33
PRKCE Q02156 1/20 0.33
PRKCQ Q04759 1/20 0.33
PRKCD Q05655 1/20 0.33
EPHX2 P34913 1/20 0.32
CYP1A2 P05177 2/20 0.31
MEN1 O00255 1/20 0.30
GMNN O75496 1/20 0.30
HSP90AA1 P07900 1/20 0.30
BLM P54132 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
NR1H4 Q96RI1 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
SCHEMBL29107167 0.90 LMNA (0.53) LMNAMAPTMAPK1ALDH1A1PRKCA
SCHEMBL29107166 0.88 LMNA (0.61) LMNATSHRMAPTMAPK1ALDH1A1
SCHEMBL11273431 0.88 CYP1A2 (0.46) LMNATSHRMAPTMAPK1ALDH1A1
SCHEMBL11578018 0.87 LMNA (0.65) LMNATSHRMAPTMAPK1ALDH1A1
Hydrogen Sulfide SCHEMBL27766386 0.85 LMNA (0.62) LMNATSHRMAPTMAPK1ALDH1A1
SCHEMBL16907298 0.85 ALDH1A1 (0.44) LMNATSHRMAPTMAPK1ALDH1A1
SCHEMBL28299320 0.80
SCHEMBL6610408 0.79 PRKCA (0.56) LMNAMAPTALDH1A1PRKCAPRKCE
SCHEMBL10011163 0.78 LMNA (0.44) LMNATSHRMAPTMAPK1ALDH1A1
SCHEMBL28639405 0.78

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-10941252-B2 Silicone copolymers, methods of making, and articles 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-03-09 US disclosed
US-20190263972-A1 SILICONE COPOLYMERS, METHODS OF MAKING, AND ARTICLES 3M INNOVATIVE PROPERTIES COMPANY (US) 2019-08-29 US disclosed
EP-0214853-B1 Viscoelastic collagen solution for ophthalmic use and method of preparation MINNESOTA MINING & MFG (US) 1994-11-30 EP disclosed
US-4883864-A COUPLED AND FREE AMINE GROUPS CAPPED WITH UREA OR AMIDE GROUPS, EYE SURGERY MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-11-28 US disclosed
US-4851513-A Viscoelastic collagen solution for opthalmic use and method of preparation MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-07-25 US disclosed
US-4713446-A COLLAGEN COUPLED TO CARBONYL OR SULFONYL GROUPS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1987-12-15 US disclosed
EP-0214853-A2 Viscoelastic collagen solution for ophthalmic use and method of preparation MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1987-03-18 EP disclosed