SCHEMBL2282136

SCHEMBL2282136

C=C(CC)C(=O)O.C=C(CN(C)C)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.46
PAX8 Q06710 1/20 0.40
TET2 Q6N021 4/20 0.34
FFAR3 O14843 1/20 0.33
TET3 O43151 1/20 0.32
TET1 Q8NFU7 1/20 0.32
ABL1 P00519 1/20 0.32
GRIK1 P39086 1/20 0.31
GRIK2 Q13002 1/20 0.31
GRM1 Q13255 1/20 0.31
GRM2 Q14416 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SRC P12931 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
SCHEMBL164434 0.91
Hydrochloric Acid SCHEMBL20699298 0.88 EGFR (0.53) EGFRPAX8TET2TET3TET1
N,N-Dimethylethanaminium SCHEMBL444410 0.86 TET2 (0.37) EGFRTET2FFAR3TET3TET1
Trimethylammonium SCHEMBL20907 0.85 FFAR3 (0.40) EGFRTET2FFAR3TET3TET1
Trimethylammonium SCHEMBL460229 0.83 FFAR3 (0.38) EGFRTET2FFAR3TET3TET1
Trimethylammonium SCHEMBL2478116 0.83 FFAR3 (0.38) EGFRTET2FFAR3TET3TET1
Trimethylammonium SCHEMBL9095442 0.83 FFAR3 (0.38) EGFRTET2FFAR3TET3TET1
Trimethylammonium SCHEMBL1226064 0.83 FFAR3 (0.38) EGFRTET2FFAR3TET3TET1
Trimethylammonium SCHEMBL141478 0.83 FFAR3 (0.38) EGFRTET2FFAR3TET3TET1
SCHEMBL17865 0.83

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
US-7992990-B2 Recording apparatus FUJI XEROX CO., LTD. (JP) 2011-08-09 US disclosed
US-20080062241-A1 Recording apparatus FUJI XEROX CO., LTD. 2008-03-13 US disclosed