SCHEMBL13506563

SCHEMBL13506563

CC(C)(C)c1cccc(C(C)(C)C)c1OCC(CO)(CO)COP(=O)(O)OP(=O)(O)O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 8/20 0.33
ALDH1A1 P00352 3/20 0.32
GAA P10253 1/20 0.32
NAMPT P43490 1/20 0.31
NR1H4 Q96RI1 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
Pyrophosphoric Acid SCHEMBL13506565 0.88 NAMPT (0.34) ALDH1A1GAANAMPTNR1H4
SCHEMBL5181891 0.86 BTN3A1 (0.34) BTN3A1ALDH1A1
SCHEMBL13506561 0.80 INPPL1 (0.33) BTN3A1ALDH1A1GAANAMPTNR1H4
SCHEMBL27889673 0.79 CA2 (0.42) ALDH1A1GAANAMPTNR1H4
SCHEMBL5266593 0.78 CYP2C9 (0.42) BTN3A1ALDH1A1
SCHEMBL12980963 0.75 BTN3A1 (0.31) BTN3A1
SCHEMBL12983472 0.75 INPPL1 (0.33) ALDH1A1GAANAMPTNR1H4
SCHEMBL28979480 0.74 ALDH1A1 (0.50) ALDH1A1GAA
Pyrophosphoric Acid SCHEMBL5181896 0.74 HSPA5 (0.36) ALDH1A1
SCHEMBL134477 0.72 BTN3A1 (0.43) BTN3A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2518535-A1 FILM MIRROR AND PROCESS FOR PRODUCTION THEREOF, AND REFLECTION DEVICE FOR SOLAR POWER GENERATION PURPOSES Konica Minolta Opto, Inc. (JP) 2012-10-31 EP disclosed