SCHEMBL28077944

SCHEMBL28077944

CCCCCCCCCCCCCCCCN(C)CC.CCCCCCCCCCCC[Si](C)(OCC)OCC

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.38
S1PR2 O95136 1/20 0.35
S1PR1 P21453 1/20 0.35
S1PR3 Q99500 1/20 0.35
S1PR5 Q9H228 1/20 0.35
KDM5A P29375 7/20 0.34
KDM4C Q9H3R0 6/20 0.33
GGPS1 O95749 3/20 0.33
PHF8 Q9UPP1 2/20 0.33
KDM5C P41229 1/20 0.31
KDM5B Q9UGL1 1/20 0.31
KDM4A O75164 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
SCHEMBL614714 0.87 KDM5A (0.33) KDM5AKDM4C
SCHEMBL14910493 0.83 TSHR (0.40) DNM1
SCHEMBL555717 0.83 TSHR (0.40) DNM1
SCHEMBL20360059 0.83 TSHR (0.40) DNM1
SCHEMBL17191748 0.83 TSHR (0.40) DNM1
SCHEMBL23658245 0.83 TSHR (0.40) DNM1
SCHEMBL216112 0.83 TSHR (0.40) DNM1
SCHEMBL996934 0.83 TSHR (0.40) DNM1
SCHEMBL20359349 0.83 TSHR (0.40) DNM1
SCHEMBL271835 0.83 TSHR (0.40) DNM1

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
CN-103242702-B Uv-curing type ink jet compositions and record thing 精工爱普生株式会社 2016-07-13 CN disclosed