SCHEMBL28893422

SCHEMBL28893422

CO[C](CCCNCCN)OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.50
CA6 P23280 5/20 0.50
CA7 P43166 5/20 0.50
CA9 Q16790 5/20 0.50
CA14 Q9ULX7 5/20 0.50
CA5B Q9Y2D0 5/20 0.50
CA2 P00918 4/20 0.50
CA4 P22748 4/20 0.50
CA5A P35218 4/20 0.50
CA3 P07451 3/20 0.50
MEN1 O00255 2/20 0.48
RECQL P46063 2/20 0.48
KMT2A Q03164 2/20 0.48
LMNA P02545 3/20 0.46
TDP1 Q9NUW8 3/20 0.46
ALOX15 P16050 3/20 0.46
CA1 P00915 2/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL1895315 0.79
SCHEMBL21056172 0.79 CA12 (0.42) CA12CA6CA7CA9CA14
SCHEMBL3233172 0.77 PAOX (0.44) CA12CA6CA7CA9CA14
SCHEMBL26659403 0.75 CA12 (0.55) CA12CA6CA7CA9CA14
Methyl Alcohol SCHEMBL28111848 0.73
SCHEMBL29326851 0.71 CA12 (0.50) CA12CA6CA7CA9CA14
SCHEMBL8310112 0.70
SCHEMBL27093633 0.70 CA12 (0.55) CA12CA6CA7CA9CA14
Methyl Alcohol SCHEMBL28304671 0.70 CA12 (0.79) CA12CA6CA7CA9CA14
SCHEMBL26667 0.69 CA12 (0.85) CA12CA6CA7CA9CA14

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-111363515-B Two-component condensed type organic silicon adhesive, composition for forming same and application thereof 富乐(苏州)新材料有限公司 2021-11-23 CN disclosed
CN-111363515-A Two-component condensed type organic silicon adhesive, composition for forming same and application thereof 苏州天山新材料技术有限公司 2020-07-03 CN disclosed