SCHEMBL31494293

SCHEMBL31494293

CCCN(C)OC(=O)CC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
DNM1 Q05193 1/20 0.37
NAAA Q02083 1/20 0.35
CA12 O43570 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRM3 P20309 1/20 0.32
CHRNA4 P43681 1/20 0.32
KDM6B O15054 1/20 0.32
KDM5C P41229 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32

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
SCHEMBL3885211 0.85 DNM1 (0.46) ALDH1A1DNM1NAAAKDM5C
SCHEMBL4891467 0.83 DNM1 (0.49) DNM1NAAA
SCHEMBL254321 0.83 DNM1 (0.44) ALDH1A1DNM1NAAAKDM5CPHF8
SCHEMBL11550778 0.80
SCHEMBL28599459 0.78 ALDH1A1 (0.40) ALDH1A1DNM1NAAACA12CA2
SCHEMBL626477 0.74
Hydrochloric Acid SCHEMBL519939 0.72
SCHEMBL29364311 0.72 ALDH1A1 (0.38) ALDH1A1DNM1NAAAMEN1KMT2A
SCHEMBL29055152 0.71 TSHR (0.41) ALDH1A1CA12CA2CA9KMT2A
SCHEMBL29781093 0.71 TSHR (0.44) ALDH1A1CA12CA2CA9TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025084429-A1 SILICA PARTICLES FOR COATING COMPOSITION AND LAMINATED SUBSTRATE 日産化学株式会社 2025-04-24 WO disclosed