SCHEMBL14830394

SCHEMBL14830394

O=C(O)C1CCC2OC2C1.OCC1CCC(CO)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
PLG P00747 1/20 0.41
PLAT P00750 1/20 0.41
TFPI2 P48307 4/20 0.41
PMP22 Q01453 2/20 0.41
TSHR P16473 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GMNN O75496 1/20 0.41
TP53 P04637 1/20 0.41
NFKB1 P19838 1/20 0.41
THPO P40225 1/20 0.41
ANPEP P15144 1/20 0.34
ENPEP Q07075 1/20 0.34
PPM1B O75688 3/20 0.33
PTPN1 P18031 3/20 0.33
PPP1CC P36873 3/20 0.33
ACE P12821 1/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C1 Q04828 1/20 0.33
GABRP O00591 1/20 0.32

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
SCHEMBL1859238 1.00 LMNA (0.41) LMNAPLGPLATTFPI2PMP22
SCHEMBL27516610 0.95 LMNA (0.40) LMNAPLGPLATTFPI2PMP22
Ethylene Glycol SCHEMBL6404800 0.87 TFPI2 (0.45) LMNAPLGPLATTFPI2PMP22
Ethylene Glycol SCHEMBL259159 0.87 TFPI2 (0.45) LMNAPLGPLATTFPI2PMP22
SCHEMBL4948347 0.87 TFPI2 (0.52) LMNAPLGPLATTFPI2PMP22
SCHEMBL2184024 0.87 TFPI2 (0.52) LMNAPLGPLATTFPI2PMP22
SCHEMBL7263479 0.87 TFPI2 (0.52) LMNAPLGPLATTFPI2PMP22
SCHEMBL4098788 0.87 TFPI2 (0.52) LMNAPLGPLATTFPI2PMP22
SCHEMBL2726787 0.87 TFPI2 (0.52) LMNAPLGPLATTFPI2PMP22
SCHEMBL4109815 0.87 TFPI2 (0.52) LMNAPLGPLATTFPI2PMP22

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
WO-2014152543-A2 OXETANE-CONTAINING COMPOUNDS AND COMPOSITIONS THEREOF Henkel IP & Holding GmbH (DE) 2014-09-25 WO disclosed
US-20140264165-A1 OXETANE-CONTAINING COMPOUNDS AND COMPOSITIONS THEREOF HENKEL CORPORATION (US) 2014-09-18 US disclosed
EP-2760910-A2 OXETANE-CONTAINING COMPOUNDS AND COMPOSITIONS THEREOF Henkel AG&Co. KGAA (DE) 2014-08-06 EP disclosed
US-20140209951-A1 OXETANE-CONTAINING COMPOUNDS AND COMPOSITIONS THEREOF Henkel IP & Holding GmbH (DE) 2014-07-31 US disclosed
WO-2013049154-A2 OXETANE-CONTAINING COMPOUNDS AND COMPOSITIONS THEREOF HENKEL AG & CO. KGAA (DE) 2013-04-04 WO disclosed