SCHEMBL15964147

SCHEMBL15964147

C=C(COCOCC)C(=O)OCOC1CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.33
ALDH1A1 P00352 3/20 0.32
THRB P10828 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
NAAA Q02083 1/20 0.31
EPHX2 P34913 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
SCHEMBL14616284 0.87 NPSR1 (0.33) EPHX1NPSR1
SCHEMBL24518003 0.79 ALDH1A1 (0.39) EPHX1ALDH1A1THRBNPSR1NAAA
SCHEMBL5078386 0.77 ALDH1A1 (0.42) ALDH1A1THRBNPSR1
SCHEMBL14982776 0.76 ALDH1A1 (0.43) EPHX1ALDH1A1THRBNPSR1NAAA
SCHEMBL36342 0.76 ALDH1A1 (0.43) EPHX1ALDH1A1THRBNPSR1NAAA
SCHEMBL15964114 0.76 GRM1 (0.38) ALDH1A1EPHX2
SCHEMBL14770400 0.75
SCHEMBL13554293 0.74 NAAA (0.35) EPHX1ALDH1A1NPSR1NAAAEPHX2
SCHEMBL1664370 0.74 ALDH1A1 (0.44) EPHX1ALDH1A1THRBNAAA
SCHEMBL14770424 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9122147-B2 Pattern forming process SHIN-ESTU CHEMICAL CO., LTD. (JP) 2015-09-01 US disclosed
US-9122147-B2 Pattern forming process SHIN-ESTU CHEMICAL CO., LTD. (JP) 2015-09-01 US disclosed
US-20140235057-A1 PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-08-21 US disclosed
US-20140235057-A1 PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-08-21 US disclosed