SCHEMBL8985179

SCHEMBL8985179

O=C1C=CC(CCc2ccccc2)O1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.46
CYP3A4 P08684 1/20 0.43
PLA2G6 O60733 2/20 0.38
GSK3A P49840 2/20 0.38
GSK3B P49841 2/20 0.38
MGLL Q99685 1/20 0.38
PLA2G4A P47712 1/20 0.38
DAO P14920 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37

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
SCHEMBL6719657 0.79 TSHR (0.41) FASNCYP3A4DAO
SCHEMBL28661302 0.76 FASN (0.37) FASNSLC6A2SLC6A4SLC6A3
SCHEMBL6336780 0.75 LMNA (0.49) DAO
SCHEMBL7081405 0.71 CYP3A4 (0.54) FASNCYP3A4SLC6A2SLC6A4SLC6A3
SCHEMBL7081400 0.71 CYP3A4 (0.54) FASNCYP3A4SLC6A2SLC6A4SLC6A3
SCHEMBL11138811 0.71 FASN (0.58) FASNCYP3A4PLA2G6PLA2G4ASLC6A2
SCHEMBL7990706 0.71
SCHEMBL4501425 0.69 CYP3A4 (0.48) FASNCYP3A4PLA2G6PLA2G4ADAO
SCHEMBL9993726 0.68 PDCD4 (0.38)
SCHEMBL2600461 0.68 CA12 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5541221-A Pharmaceutical compositions and method for administering 3 and 4-substituted 2(5H)-furanones to a mammal for inhibiting bone loss ALLERGAN (US) 1996-07-30 US disclosed
EP-0637240-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING 3 AND 4-SUBSTITUTED 2(5H)-FURANONES FOR INHIBITING BONE LOSS ALLERGAN, INC. (US) 1995-02-08 EP disclosed
US-5387606-A Pharmaceutical compositions and method for administering 3 and 4-substituted 2(5H)-furanones to a mammal for inhibiting bone loss ALLERGAN, INC. (US) 1995-02-07 US disclosed
US-5268387-A Containing ester or carbamate group ALLERGAN, INC. (US) 1993-12-07 US disclosed
WO-1993021915-A1 PHARMACEUTICAL COMPOSITIONS FOR INHIBITING BONE LOSS CONTAINING 3 AND 4-SUBSTITUTED 2(5H)-FURANONES ALLERGAN, INC. (US) 1993-11-11 WO disclosed
WO-1991016055-A1 2(5H)-FURANONES SUBSTITUTED IN THE 5 AND OR IN THE 4 POSITION, AS ANTI-INFLAMMATORY AGENTS ALLERGAN, INC. (US) 1991-10-31 WO disclosed