SCHEMBL6549231

SCHEMBL6549231

O=C(O)OC1C2CCC(O2)C1OC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TFPI2 P48307 6/20 0.48
LMNA P02545 4/20 0.48
GMNN O75496 3/20 0.48
PMP22 Q01453 3/20 0.48
TP53 P04637 2/20 0.48
NFKB1 P19838 2/20 0.48
THPO P40225 2/20 0.48
KDM4E B2RXH2 2/20 0.48
TSHR P16473 1/20 0.48
PPM1B O75688 4/20 0.41
PPP1CC P36873 4/20 0.41
PTPN1 P18031 3/20 0.41
MAPK1 P28482 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CYP2C19 P33261 1/20 0.33
STAT6 P42226 1/20 0.33
HIF1A Q16665 1/20 0.33
NPC1 O15118 1/20 0.33
MTOR P42345 1/20 0.33

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
SCHEMBL8968922 0.79 PPM1B (0.64) TFPI2LMNAGMNNPMP22TP53
SCHEMBL7930114 0.73 TFPI2 (0.41) TFPI2LMNAGMNNPMP22TP53
SCHEMBL8644323 0.71 CA1 (0.31)
SCHEMBL2936710 0.71 CA1 (0.31)
SCHEMBL1554143 0.71 CA1 (0.31)
SCHEMBL933668 0.71 CA1 (0.31)
SCHEMBL8932121 0.71 CA1 (0.31)
SCHEMBL21134827 0.71 CHRNA7 (0.47) LMNAPTPN1
SCHEMBL7023124 0.69
SCHEMBL10599147 0.69 GMNN (0.35) TFPI2LMNAGMNNPMP22TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480914-A1 METHOD FOR PREVENTING THE UNCONTROLLED GROWTH OF MICROORGANISMS IN WATER Beta Tec Hopfenprodukte Gmbh (DE) 2004-12-01 EP claimed
WO-2003074431-A1 METHOD FOR PREVENTING THE UNCONTROLLED GROWTH OF MICROORGANISMS IN WATER BETA TEC HOPFENPRODUKTE GMBH (DE) 2003-09-12 WO claimed
EP-0496608-B1 Substituted pyridinesulfonamide compound or its salt, process for preparing the same, and herbicide containing the same ISHIHARA SANGYO KAISHA (JP) 1995-09-20 EP claimed
EP-0385231-B1 Use of derivatives of N-phenyl-3,4,5,6-tetrahydrophthalimide in the desiccation and abscission of plant organs BASF AG (DE) 1996-09-18 EP disclosed
EP-0412364-B1 Synergistic mixture of an urea and a diphenyl ether derivative for the abscission of parts of plants BASF AG (DE) 1993-11-03 EP disclosed
EP-0412365-B1 Use of diphenylether derivatives for the desiccation and abscission of plant organs BASF AG (DE) 1993-11-03 EP disclosed
EP-0412364-A1 Synergistic mixture of an urea and a diphenyl ether derivative for the abscission of parts of plants BASF Aktiengesellschaft (DE) 1991-02-13 EP disclosed
EP-0412365-A1 Use of diphenylether derivatives for the desiccation and abscission of plant organs BASF Aktiengesellschaft (DE) 1991-02-13 EP disclosed
EP-0385231-A1 Use of derivatives of N-phenyl-3,4,5,6-tetrahydrophthalimide in the desiccation and abscission of plant organs BASF Aktiengesellschaft (DE) 1990-09-05 EP disclosed