SCHEMBL7758349

SCHEMBL7758349

CC(C)CCCC(C)CCOP(O)(=S)OCCC(C)CCCC(C)C

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
BLM P54132 1/20 0.41
PTPN1 P18031 2/20 0.37
MEN1 O00255 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX15 P16050 1/20 0.37
KMT2A Q03164 1/20 0.37
FDPS P14324 2/20 0.36
GGPS1 O95749 1/20 0.34
GSTO1 P78417 1/20 0.32
LPAR2 Q9HBW0 3/20 0.31
LPAR3 Q9UBY5 3/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31

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
SCHEMBL14859459 0.83 CA12 (0.41) MEN1KMT2ALPAR2LPAR3CA12
SCHEMBL30859388 0.82 LMNA (0.50) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL9555227 0.81 LMNA (0.48) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL9554689 0.81 LMNA (0.48) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL9555371 0.81 LMNA (0.48) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL9555233 0.81 LMNA (0.48) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL9555488 0.81 LMNA (0.48) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL9554941 0.81 LMNA (0.48) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL9555114 0.81 LMNA (0.48) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL12983932 0.81 LMNA (0.48) LMNABLMPTPN1MEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001056933-A2 COMBINED SUPPORTED LIQUID MEMBRANE/STRIP DISPERSION PROCESSES AND EXTRACTANTS COMMODORE SEPARATION TECHNOLOGIES, INC. (US) 2001-08-09 WO claimed
US-6291705-B1 AS EXTRACTANT USEFUL FOR THE REMOVAL AND RECOVERY OF METALS FROM WASTE WATERS AND PROCESS STREAMS COMMODORE SEPARATION TECHNOLOGIES, INC. 2001-09-18 US disclosed
WO-2001056933-A2 COMBINED SUPPORTED LIQUID MEMBRANE/STRIP DISPERSION PROCESSES AND EXTRACTANTS COMMODORE SEPARATION TECHNOLOGIES, INC. (US) 2001-08-09 WO disclosed