SCHEMBL2774478

SCHEMBL2774478

C=C(CC(=O)O)C(=O)O[Si](OC)(OC)OC

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 1/20 0.33
EGLN1 Q9GZT9 1/20 0.32
LDHA P00338 1/20 0.31
SRR Q9GZT4 1/20 0.31

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
SCHEMBL291075 0.84 ALDH1A1 (0.33) ALDH1A1
SCHEMBL22499925 0.79 ALDH1A1 (0.31) ALDH1A1
SCHEMBL27876442 0.79 ALOX15 (0.39) ALOX15HSD17B10ALDH1A1EGLN1LDHA
SCHEMBL60440 0.78 ALDH1A1 (0.48) ALOX15HSD17B10ALDH1A1EGLN1LDHA
SCHEMBL11694969 0.76 ALDH1A1 (0.46) ALOX15HSD17B10ALDH1A1EGLN1LDHA
SCHEMBL11696832 0.76 ALDH1A1 (0.46) ALOX15HSD17B10ALDH1A1EGLN1LDHA
Ammonia Solution, Strong SCHEMBL27793329 0.76 ALDH1A1 (0.46) ALOX15HSD17B10ALDH1A1EGLN1LDHA
Ethylene SCHEMBL27718140 0.76 ALDH1A1 (0.46) ALOX15HSD17B10ALDH1A1EGLN1LDHA
SCHEMBL909896 0.76 ALDH1A1 (0.33) ALDH1A1
SCHEMBL29165215 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102458690-B Medicinal inhalation devices and components thereof 3M INNOVATIVE PROPERTIES CO 2014-08-13 CN disclosed
US-8616201-B2 Medicinal inhalation devices and components thereof 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-12-31 US disclosed
CN-102458690-A Medicinal inhalation device and components thereof 3M INNOVATIVE PROPERTIES CO 2012-05-16 CN disclosed
US-20100263667-A1 MEDICINAL INHALATION DEVICES AND COMPONENTS THEREOF 3M INNOVATIVE PROPERTIES COMPANY 2010-10-21 US disclosed