SCHEMBL8985124

SCHEMBL8985124

CCCCCCCCCC1C=CC(=O)O1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDCD4 Q53EL6 5/20 0.43
CYP1A2 P05177 2/20 0.42
DNTT P04053 1/20 0.42
PPARG P37231 2/20 0.41
CES2 O00748 1/20 0.41
GRM2 Q14416 5/20 0.38
NLRP3 Q96P20 1/20 0.38
POLB P06746 1/20 0.36
FASN P49327 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
SCHEMBL12673923 1.00 PDCD4 (0.43) PDCD4CYP1A2DNTTPPARGCES2
SCHEMBL3663425 1.00 PDCD4 (0.43) PDCD4CYP1A2DNTTPPARGCES2
SCHEMBL2315807 1.00 PDCD4 (0.43) PDCD4CYP1A2DNTTPPARGCES2
SCHEMBL1895638 1.00 PDCD4 (0.43) PDCD4CYP1A2DNTTPPARGCES2
SCHEMBL3505080 0.98 PDCD4 (0.40) PDCD4CYP1A2DNTTPPARGCES2
SCHEMBL9993726 0.92 PDCD4 (0.38) PDCD4CYP1A2DNTTPPARGCES2
SCHEMBL30503116 0.88 DNTT (0.39) PDCD4CYP1A2DNTTPPARGCES2
SCHEMBL9991171 0.81 PDCD4 (0.37) PDCD4
SCHEMBL16431359 0.80 PDCD4 (0.38) PDCD4CYP1A2CES2
SCHEMBL9995097 0.80 PAOX (0.36) PDCD4DNTTPPARGNLRP3

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 8 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
EP-0524979-A4 2(5H)-FURANONES SUBSTITUTED IN THE 5 AND OR IN THE 4 POSITION, AS ANTI-INFLAMMATORY AGENTS 1993-03-10 EP disclosed
EP-0524979-A1 2(5H)-FURANONES SUBSTITUTED IN THE 5 AND OR IN THE 4 POSITION, AS ANTI-INFLAMMATORY AGENTS ALLERGAN, INC. (US) 1993-02-03 EP 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