SCHEMBL5520002

SCHEMBL5520002

O=C1OCCOC(=O)c2ccc1cc2[Na]

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRF1 P14222 10/20 0.38
LMNA P02545 3/20 0.34
MAPT P10636 2/20 0.34
GAA P10253 1/20 0.34
PTPRC P08575 1/20 0.33
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.31
RECQL P46063 1/20 0.31
ACHE P22303 1/20 0.31
PTGS2 P35354 1/20 0.30

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
SCHEMBL11829921 0.79 ALOX15 (0.34) PRF1LMNAMAPTALDH1A1KDM4E
SCHEMBL5009684 0.78 ALOX5 (0.43) PRF1LMNAMAPTGAAMAOA
SCHEMBL17628649 0.73 ITGB2 (0.43) PRF1LMNAMAPTMAOAMAOB
SCHEMBL3874923 0.73 ITGB2 (0.43) PRF1LMNAMAPTMAOAMAOB
SCHEMBL22419 0.73 ITGB2 (0.43) PRF1LMNAMAPTMAOAMAOB
SCHEMBL4378541 0.73 MAOA (0.38) PRF1LMNAMAPTPTPRCMAOA
SCHEMBL27848386 0.73 PRF1 (0.45) PRF1ALDH1A1KDM4E
SCHEMBL7799448 0.73 PRF1 (0.40) PRF1MAPTGAAALDH1A1KDM4E
SCHEMBL36556 0.73 GSTP1 (0.45) MAPTALDH1A1KDM4E
SCHEMBL2232672 0.73 KMT2A (0.36) LMNAALDH1A1KDM4EHTTPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1773590-A1 CONTAINERS INCORPORATING POLYESTER-CONTAINING MULTILAYER STRUCTURES E.I.Du pont de nemours and company (US) 2007-04-18 EP claimed
WO-2006017597-A1 CONTAINERS INCORPORATING POLYESTER-CONTAINING MULTILAYER STRUCTURES E.I. DUPONT DE NEMOURS AND COMPANY (US) 2006-02-16 WO claimed
EP-3214132-B1 POLYESTER RESIN COMPOSITION AND METHOD FOR PRODUCING SAME TORAY INDUSTRIES (JP) 2020-03-18 EP disclosed
EP-3214132-A1 POLYESTER RESIN COMPOSITION AND METHOD FOR PRODUCING SAME Toray Industries, Inc. (JP) 2017-09-06 EP disclosed
EP-0084203-A1 Ultra-fine sheath-core composite fibers and composite sheets made thereof TORAY INDUSTRIES, INC. (JP) 1983-07-27 EP disclosed