SCHEMBL15445480

SCHEMBL15445480

O=C(O)CCC(=O)OCCCCCC(=O)OCCOCCOC(=O)CCCCCOC(=O)CCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.52
NPC1 O15118 1/20 0.48
ALDH1A1 P00352 2/20 0.44
PAM P19021 2/20 0.43
HTR2C P28335 1/20 0.42
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
TSHR P16473 3/20 0.41
LMNA P02545 3/20 0.41
NFKB1 P19838 1/20 0.41
PMP22 Q01453 1/20 0.41
DNM1 Q05193 1/20 0.40
EPHX2 P34913 1/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NAAA Q02083 1/20 0.38
ADRA2A P08913 1/20 0.36
ADRA1A P35348 1/20 0.36

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
SCHEMBL13419861 1.00 DGKA (0.52) DGKANPC1ALDH1A1PAMHTR2C
SCHEMBL15445484 0.94 DGKA (0.52) DGKANPC1ALDH1A1PAMTSHR
SCHEMBL13821164 0.92 NPC1 (0.46) DGKANPC1ALDH1A1HTR2CTSHR
SCHEMBL421182 0.92 DGKA (0.50) DGKANPC1ALDH1A1PAMTSHR
SCHEMBL17637589 0.90 DGKA (0.57) DGKANPC1ALDH1A1PAMTSHR
SCHEMBL25216537 0.88 ALDH1A1 (0.56) DGKANPC1ALDH1A1HTR2CTSHR
SCHEMBL9972407 0.88 DGKA (0.54) DGKANPC1ALDH1A1PAMTSHR
SCHEMBL10783946 0.88 DGKA (0.54) DGKANPC1ALDH1A1PAMTSHR
SCHEMBL14153186 0.88 LMNA (0.45) DGKANPC1ALDH1A1TSHRLMNA
SCHEMBL127836 0.88 LMNA (0.45) DGKANPC1ALDH1A1TSHRLMNA

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-9250356-B2 Photochromic polymers VIVIMED LABS EUROPE LTD (GB) 2016-02-02 US disclosed
US-20140027684-A1 PHOTOCHROMIC POLYMERS VIVIMED LABS EUROPE LTD (GB) 2014-01-30 US disclosed