SCHEMBL5874140

SCHEMBL5874140

O=C(CCC(=O)ON1CCCCC1)ON1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.38
MAPT P10636 2/20 0.38
POLB P06746 2/20 0.38
L3MBTL1 Q9Y468 3/20 0.37
ATM Q13315 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
CYP1A2 P05177 1/20 0.35
MAPK1 P28482 1/20 0.35
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL22437603 0.91 SMN1; SMN2 (0.44) ALDH1A1MAPTPOLBL3MBTL1ATM
SCHEMBL5874669 0.91 ATM (0.43) ALDH1A1MAPTPOLBL3MBTL1ATM
SCHEMBL5874399 0.91 L3MBTL1 (0.39) ALDH1A1MAPTPOLBL3MBTL1ATM
SCHEMBL442464 0.89 L3MBTL1 (0.38) ALDH1A1MAPTPOLBL3MBTL1ATM
SCHEMBL14228809 0.88 ATM (0.44) ALDH1A1MAPTPOLBL3MBTL1ATM
SCHEMBL4107060 0.87 TSHR (0.36) ALDH1A1POLBTSHRLMNA
SCHEMBL4124283 0.87 ALDH1A1 (0.44) ALDH1A1MAPTPOLBL3MBTL1SMN1; SMN2
SCHEMBL28252868 0.87 L3MBTL1 (0.36) ALDH1A1MAPTPOLBL3MBTL1ATM
SCHEMBL2950462 0.85 ALDH1A1 (0.35) ALDH1A1MAPTPOLBL3MBTL1ATM
SCHEMBL27474184 0.85 ALDH1A1 (0.43) ALDH1A1MAPTPOLBL3MBTL1SMN1; SMN2

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
EP-3710550-A1 HEAT TRANSFER COMPOSITIONS, METHODS, AND SYSTEMS Honeywell International Inc. (US) 2020-09-23 EP disclosed
CN-109306104-A A kind of EVA intermediate coat 刘若慧 2019-02-05 CN disclosed
CN-102695771-A Composition comprising cis-1,1,1,4,4,4-hexafluoro-2-butene and trans-1,2-dichloroethylene, apparatus containing same and methods of producing cooling therein DU PONT 2012-09-26 CN disclosed
CN-102459498-A Cooler equipment containing cis-1, 1,1,4,4, 4-hexafluoro-2-butene and refrigeration method thereof DU PONT 2012-05-16 CN disclosed
US-7128976-B2 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2006-10-31 US disclosed
US-20030091838-A1 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2003-05-15 US disclosed
CN-1076928-A 1-[2-arylsulfonyl amino)-and the 1-oxoethyl] piperidine derivative and preparation and the application in treatment SYNTHELABO (FR) 1993-10-06 CN disclosed