SCHEMBL5459582

SCHEMBL5459582

CCC(CC)(CCN)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FDPS P14324 6/20 0.35
LMNA P02545 1/20 0.35
ADRB3 P13945 1/20 0.35
PDE4D Q08499 1/20 0.35
PDE3A Q14432 1/20 0.35
SMPD1 P17405 5/20 0.35
BTN3A1 O00481 3/20 0.33
BLM P54132 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL5462390 0.85 SMPD1 (0.43) FDPSLMNAADRB3PDE4DPDE3A
SCHEMBL5459837 0.77 FDPS (0.47) FDPSSMPD1
SCHEMBL6706861 0.72 BTN3A1 (0.39) FDPSSMPD1BTN3A1BLMTDP1
SCHEMBL28766325 0.71 BTN3A1 (0.42) FDPSSMPD1BTN3A1BLMTDP1
SCHEMBL5455779 0.71 BTN3A1 (0.42) FDPSSMPD1BTN3A1BLMTDP1
SCHEMBL4276586 0.69 FDPS (0.47) FDPSLMNAADRB3PDE4DPDE3A
SCHEMBL5908847 0.69 SMPD1 (0.47) FDPSSMPD1
SCHEMBL19455878 0.68 BTN3A1 (0.36) FDPSSMPD1BTN3A1BLMTDP1
SCHEMBL19455939 0.68 BTN3A1 (0.36) FDPSSMPD1BTN3A1BLMTDP1
SCHEMBL27469482 0.68 SMPD1 (0.52) FDPSSMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070210476-A1 Machinable Resin Molded Product, Material For Forming The Same, And Model Made Of The Same SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2007-09-13 US disclosed
EP-1728832-A1 MOLDING OF RESIN FOR CUTTING OPERATION, MATERIAL FOR FORMATION THEREOF AND MODEL Sanyo Chemical Industries, Ltd. (JP) 2006-12-06 EP disclosed