Ether

Ether

SCHEMBL7074006

C=CCOC(=O)OCCCCC.CCOCC

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.51
HPGD P15428 1/20 0.44
PLA2G2C Q5R387 1/20 0.43
NAAA Q02083 1/20 0.42
HCAR2 Q8TDS4 2/20 0.41
EPHX1 P07099 1/20 0.40
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 2/20 0.37
CES2 O00748 1/20 0.37
CYP3A4 P08684 2/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
RAD52 P43351 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
FAAH O00519 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
SCHEMBL9245159 0.93 TSHR (0.58) TSHRHPGDPLA2G2CNAAAHCAR2
SCHEMBL309590 0.93 TSHR (0.58) TSHRHPGDPLA2G2CNAAAHCAR2
Ammonia Solution, Strong SCHEMBL18921479 0.91 TSHR (0.56) TSHRHPGDPLA2G2CNAAAHCAR2
SCHEMBL10948447 0.91 TSHR (0.61) TSHRHPGDPLA2G2CNAAAHCAR2
SCHEMBL28747016 0.91 TSHR (0.56) TSHRHPGDPLA2G2CNAAAHCAR2
SCHEMBL7267486 0.88 TSHR (0.57) TSHRHPGDPLA2G2CNAAAHCAR2
Ether SCHEMBL21624615 0.86 ALDH1A1 (0.46) TSHRHPGDTDP1ALDH1A1CYP3A4
SCHEMBL28099112 0.85 TSHR (0.50) TSHRHPGDPLA2G2CNAAAHCAR2
SCHEMBL2023648 0.84 TSHR (0.48) TSHRHPGDPLA2G2CATMTDP1
SCHEMBL1557157 0.82 TSHR (0.50) TSHRHPGDPLA2G2CTDP1ALDH1A1

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
EP-0998901-B1 Light-responding high color-rendering makeup cosmetic preparation SHISEIDO CO LTD (JP) 2003-09-17 EP disclosed
US-6306409-B1 CHANGES ITS COLOR TO NATURAL OBSERVATION COLOR IN RESPONSE TO INTENSITY OF SURROUNDING LIGHT SHISEIDO CO., LTD. (JP) 2001-10-23 US disclosed
EP-0998901-A1 Light-responding high color-rendering makeup cosmetic preparation SHISEIDO COMPANY LIMITED (JP) 2000-05-10 EP disclosed
CN-1241133-A Extracellular matrix production promoter SHISEIDO CO LTD (JP) 2000-01-12 CN disclosed