SCHEMBL13896285

SCHEMBL13896285

C=CC(C)(CCCC(C)CCCC(C)CCCC(C)C)OP(=O)(O)O

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.54
CYP3A4 P08684 1/20 0.54
ALOX15 P16050 1/20 0.54
KMT2A Q03164 1/20 0.54
PTPN1 P18031 3/20 0.37
PTPN2 P17706 1/20 0.37
CDC25B P30305 1/20 0.37
LMNA P02545 1/20 0.37
BLM P54132 1/20 0.37
GSTO1 P78417 1/20 0.32
FDPS P14324 1/20 0.32
SMPD1 P17405 3/20 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
SCHEMBL13896293 0.77 MEN1 (0.48) MEN1CYP3A4ALOX15KMT2APTPN1
SCHEMBL28120876 0.73 MEN1 (0.52) MEN1CYP3A4ALOX15KMT2ALMNA
SCHEMBL12953253 0.72 SMPD1 (0.39) MEN1CYP3A4ALOX15KMT2ACDC25B
SCHEMBL17269277 0.72 MEN1 (0.60) MEN1CYP3A4ALOX15KMT2APTPN1
SCHEMBL17269083 0.72 MEN1 (0.60) MEN1CYP3A4ALOX15KMT2APTPN1
SCHEMBL9709450 0.71 MEN1 (0.48) MEN1CYP3A4ALOX15KMT2APTPN1
SCHEMBL23244046 0.71 MEN1 (0.46) MEN1CYP3A4ALOX15KMT2A
SCHEMBL28954181 0.71 MEN1 (0.49) MEN1CYP3A4ALOX15KMT2A
SCHEMBL17239377 0.71 ALOX15 (1.00) MEN1CYP3A4ALOX15KMT2APTPN1
SCHEMBL8079400 0.71 ALOX15 (1.00) MEN1CYP3A4ALOX15KMT2APTPN1

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-8313885-B2 Lithographic printing plate precursor comprising bi-functional compounds AGFA GRAPHICS NV (BE) 2012-11-20 US disclosed
US-20070105041-A1 Lithographic printing plate comprising bi-functional compounds AGFA-GEVAERT (BE) 2007-05-10 US disclosed