SCHEMBL7102656

SCHEMBL7102656

CCOC(C)Oc1ccc(CC(C)CC)cc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.38
SLC6A4 P31645 1/20 0.37
LMNA P02545 1/20 0.37
PPARG P37231 4/20 0.36
ACACB O00763 2/20 0.35
PPARD Q03181 3/20 0.35
POLB P06746 1/20 0.34

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
SCHEMBL7104719 0.87 SLC6A4 (0.35) PPARASLC6A4PPARGACACBPOLB
SCHEMBL14086002 0.86 PPARA (0.40) PPARASLC6A4LMNAPPARG
SCHEMBL3852488 0.83 LMNA (0.52) PPARALMNAPOLB
SCHEMBL196786 0.82 LTA4H (0.44) PPARALMNAPPARGPOLB
SCHEMBL13003657 0.82 POLB (0.50) SLC6A4LMNAACACBPOLB
SCHEMBL5701335 0.82 PPARA (0.42) PPARALMNAPPARGPOLB
SCHEMBL196655 0.81 PPARA (0.40) PPARASLC6A4LMNAPPARGPPARD
SCHEMBL24804119 0.79 PPARA (0.41) PPARALMNAPPARGPPARDPOLB
SCHEMBL2772836 0.79 PPARG (0.43) PPARALMNAPPARGACACBPOLB
SCHEMBL12907821 0.79 LMNA (0.39) PPARASLC6A4LMNAPPARGPPARD

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
EP-1113005-B1 Sulfonium salt compounds WAKO PURE CHEM IND LTD (JP) 2003-08-06 EP disclosed
EP-1238969-A2 Sulfonium salt compounds Wako Pure Chemical Industries, Ltd. (JP) 2002-09-11 EP disclosed
EP-1113005-A1 Sulfonium salt compounds Wako Pure Chemical Industries, Ltd. (JP) 2001-07-04 EP disclosed