SCHEMBL28078236

SCHEMBL28078236

C=CCOC.C=CCOC

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 2/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL41707 1.00
Hydrochloric Acid SCHEMBL15265336 0.96
Hydrogen Sulfide SCHEMBL7637414 0.96 MEN1 (0.33) MEN1POLBKMT2ATSHR
SCHEMBL7111250 0.96
Propane SCHEMBL29101715 0.93
Cyclohexane SCHEMBL18725857 0.90 ALDH1A1 (0.32) MEN1POLBKMT2AALDH1A1
Cyanide SCHEMBL6660207 0.90
SCHEMBL18335385 0.90 ALDH1A1 (0.32) MEN1POLBKMT2AALDH1A1
Ethylene Glycol SCHEMBL1803897 0.87
SCHEMBL3042853 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105612228-B Photochromic optical articles having allophanate protective coatings and methods of making the same 光学转变公司 2018-03-30 CN disclosed
CN-105849148-A Curable compositions that include hydrazide functional materials PPG工业俄亥俄公司 2016-08-10 CN disclosed