Ether

Ether

SCHEMBL5167130

CC(C)(C)C1CC=CC1=O.CCOCC

nearest known ligand 0.31

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 3/20 0.31
PSEN2 P49810 3/20 0.31
APH1B Q8WW43 3/20 0.31
NCSTN Q92542 3/20 0.31
APH1A Q96BI3 3/20 0.31
PSENEN Q9NZ42 3/20 0.31

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
SCHEMBL3191416 0.87 PSEN1 (0.30) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL19069253 0.87 PSEN1 (0.30) PSEN1PSEN2APH1BNCSTNAPH1A
Water SCHEMBL5167132 0.85
SCHEMBL19069349 0.76 PSEN1 (0.30) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL19068979 0.67
SCHEMBL9004416 0.67
Ether SCHEMBL5166791 0.66 PSEN1 (0.45) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL16321579 0.66
Ether SCHEMBL5170420 0.64
Ether SCHEMBL5170034 0.64 NFKB1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1103255-B1 METHOD OF REARING AND FEEDS TAKARA BIO INC (JP) 2007-05-02 EP disclosed
EP-1000923-B1 CYCLOPENTENONE DERIVATIVES TAKARA BIO INC (JP) 2003-12-03 EP disclosed
US-6552001-B1 Method breeding and feeds TAKARA SHUZO CO., LTD. (JP) 2003-04-22 US disclosed
EP-1106624-B1 5-MEMBERED RING COMPOUNDS TAKARA BIO INC (JP) 2003-04-09 EP disclosed
US-6380262-B1 HAVING CARCINOSTATIC ACTIVITY WHICH IS USEFUL IN A FIELD OF MEDICINE TAKARA SHUZO CO., LTD. (JP) 2002-04-30 US disclosed
EP-1170007-A1 REMEDIES Takara Shuzo Co, Ltd. (JP) 2002-01-09 EP disclosed
EP-1106624-A1 5-MEMBERED RING COMPOUNDS Takara Shuzo Co, Ltd. (JP) 2001-06-13 EP disclosed
EP-1103255-A1 METHOD OF REARING AND FEEDS Takara Shuzo Co, Ltd. (JP) 2001-05-30 EP disclosed
US-6111145-A MONO- OR DIETHER OF 4,5-DIHYDROXY-2-CYCLOPENTEN-1-ONE OF GIVEN FORMULA, SUCH AS 4,5-DI-TERTBUTYLCYCLOPENTENONE ETHER; MADE BY REACTING THE ABOVE MENTIONED DIOL WITH ALCOHOL(S); ANTICANCER AGENT TAKARA SHUZO COMPANY (JP) 2000-08-29 US disclosed
EP-1000923-A1 CYCLOPENTENONE DERIVATIVES Takara Shuzo Co, Ltd. (JP) 2000-05-17 EP disclosed