Ether

Ether

SCHEMBL10685151

CCOCC.N#CCCc1ccccc1C(=O)C(O)c1ccccc1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.38
▸ CES2 O00748 1/20 0.38
▸ CES1 P23141 1/20 0.38
▸ TSHR P16473 2/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ MMP8 P22894 1/20 0.34
▸ PPARG P37231 1/20 0.34
▸ PPARA Q07869 1/20 0.34
▸ KMT2A Q03164 2/20 0.33
▸ POLB P06746 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ FFAR1 O14842 1/20 0.33
▸ FFAR4 Q5NUL3 1/20 0.33
▸ SCN1A P35498 1/20 0.33
▸ SCN2A Q99250 1/20 0.33
▸ SCN3A Q9NY46 1/20 0.33
▸ NAAA Q02083 2/20 0.33

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
SCHEMBL10446756 0.91 LMNA (0.45) LMNACES2CES1TSHRALDH1A1
Ether SCHEMBL7911427 0.84 LMNA (0.46) LMNACES2CES1TSHRALDH1A1
Ether SCHEMBL5574743 0.82 LMNA (0.44) LMNACES2CES1ALDH1A1KDM4E
Ether SCHEMBL1071204 0.80 LMNA (0.41) LMNACES2CES1TSHRALDH1A1
Ether SCHEMBL8663300 0.80 LMNA (0.37) LMNACES2CES1ALDH1A1KDM4E
SCHEMBL452704 0.79 LMNA (0.49) LMNACES2CES1ALDH1A1KDM4E
Ether SCHEMBL11098722 0.78 LMNA (0.40) LMNACES2CES1ALDH1A1KDM4E
SCHEMBL11360041 0.77 LMNA (0.47) LMNACES2CES1TSHRALDH1A1
Benzene SCHEMBL28132336 0.77 LMNA (0.53) LMNACES2CES1TSHRALDH1A1
SCHEMBL390944 0.77 LMNA (0.53) LMNACES2CES1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-63015807-A — — None — — JP disclosed
JP-S6315807-A RADIATION-CROSSLINKABLE COMPOSITION SANNOPUKO KK 1988-01-22 — — JP disclosed
US-4162274-A Crosslinkable urethane resins containing vinyl and carboxyl groups BAYER AKTIENGESELLSCHAFT (DE) 1979-07-24 — — US disclosed
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