SCHEMBL6764110

SCHEMBL6764110

CC(O)CN(CCO)C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 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
SCHEMBL7927801 0.84 ALDH1A1 (0.41) ALDH1A1L3MBTL1MAPT
SCHEMBL925732 0.83 MAPK1 (0.36) ALDH1A1TDP1MAPK1
SCHEMBL8585662 0.78 ACACB (0.31) ALDH1A1
SCHEMBL115482 0.77 MAPT (0.42) ALDH1A1L3MBTL1MAPTMAPK1
SCHEMBL311039 0.77
SCHEMBL13049276 0.76 MAPK1 (0.32) TDP1MAPK1
SCHEMBL8588075 0.75 KDM4E (0.32) MAPT
SCHEMBL24524714 0.75 MAPT (0.40) ALDH1A1L3MBTL1MAPT
Hydrochloric Acid SCHEMBL31612219 0.75 MAPT (0.40) ALDH1A1L3MBTL1MAPT
SCHEMBL14663278 0.71 ALDH1A1 (0.38) ALDH1A1TDP1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0199194-B1 ELASTAN YARNS, THEIR PREPARATION AND INTERMEDIARY PRODUCTS NEEDED THEREFOR BAYER AG (DE) 1991-03-13 EP claimed
US-20040150134-A1 Process for the production of polyurethane urea fibers by including a combination of polydimethylsiloxane, alkoxylated polydimethylsiloxane and a fatty acid salt in the spinning solution BAYER FASER GMBH (DE) 2004-08-05 US disclosed
US-6562456-B1 Splittable elastane yarns BAYER FASER GMBH (DE) 2003-05-13 US disclosed
US-6284371-B1 OPTICAL UNIFORMITY OF DYED KNITTED FABRICS PRODUCED WITH YARNS BAYER AKTIENGESELLSCHAFT (DE) 2001-09-04 US disclosed
US-6123885-A Process for the production of elastane fibers by inclusion of a combination of PDMS and ethoxylated PDMS in the spinning solution BAYER AKTIENGESELLSCHAFT (DE) 2000-09-26 US disclosed
US-5723080-A Process for producing splittable elastane yarns BAYER FASER GMBH (DE) 1998-03-03 US disclosed
EP-0199194-B1 ELASTAN YARNS, THEIR PREPARATION AND INTERMEDIARY PRODUCTS NEEDED THEREFOR BAYER AG (DE) 1991-03-13 EP disclosed
EP-0199194-A2 Elastan yarns, their preparation and intermediary products needed therefor BAYER AG (DE) 1986-10-29 EP disclosed