SCHEMBL15440799

SCHEMBL15440799

CCCCNC(=O)NCc1cccc(CNC(C)=O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.49
HDAC3 O15379 2/20 0.47
HDAC1 Q13547 2/20 0.47
HDAC2 Q92769 2/20 0.47
HDAC8 Q9BY41 2/20 0.47
FES P07332 1/20 0.47
RET P07949 1/20 0.47
MARK3 P27448 1/20 0.47
TYK2 P29597 1/20 0.47
FLT4 P35916 1/20 0.47
SYK P43405 1/20 0.47
CLK2 P49760 1/20 0.47
CLK4 Q9HAZ1 1/20 0.47
EPHX1 P07099 3/20 0.46
PTPN1 P18031 1/20 0.46
FBP1 P09467 1/20 0.45
MTNR1A P48039 1/20 0.45
MTNR1B P49286 1/20 0.45
FAAH O00519 1/20 0.45

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
SCHEMBL2702269 0.94 EPHX2 (0.57) EPHX2SMN1; SMN2FESRETMARK3
SCHEMBL23447431 0.85 FBP1 (0.58) EPHX2SMN1; SMN2FBP1
SCHEMBL15440645 0.84 PTPN1 (0.50) SMN1; SMN2HDAC3HDAC1HDAC2HDAC8
SCHEMBL3421197 0.83 EPHX2 (0.73) EPHX2SMN1; SMN2HDAC3HDAC1HDAC2
SCHEMBL1899410 0.82 NPSR1 (0.57) HDAC3HDAC1HDAC2HDAC8
SCHEMBL8344039 0.82 EPHX1 (0.51) EPHX2FESRETMARK3TYK2
SCHEMBL15440828 0.80 EPHX2 (0.44) EPHX2SMN1; SMN2FESRETMARK3
SCHEMBL13599779 0.79 EPHX2 (0.68) EPHX2FAAH
SCHEMBL13039575 0.79 HDAC1 (0.51) HDAC3HDAC1HDAC2HDAC8
Urea SCHEMBL717178 0.79 EPHX2 (0.67) EPHX2SMN1; SMN2EPHX1PTPN1

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
US-20140024795-A1 ALIPHATIC POLYCARBONATE POLYOLS CONTAINING SILYL GROUPS NOVOMER, INC. (US) 2014-01-23 US disclosed