SCHEMBL7746283

SCHEMBL7746283

COc1ccc(OC2OC2CO)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 1/20 0.53
▸ CYP3A4 P08684 4/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ SLC5A1 P13866 1/20 0.49
▸ SLC5A2 P31639 1/20 0.49
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ CYP2C9 P11712 2/20 0.46
▸ CYP2C19 P33261 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ LGALS8 O00214 1/20 0.45
▸ IL2 P60568 1/20 0.44

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
SCHEMBL1178662 0.86 TYR (0.72) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL1178664 0.86 TYR (0.72) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL1178572 0.86 TYR (0.72) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL16689576 0.85 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL7945567 0.85 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL4187272 0.85 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL15533442 0.85 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL8388035 0.85 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL4187277 0.85 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL16785939 0.85 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A

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
JP-2001002667-A PURIFICATION OF OPTICALLY ACTIVE GLYCIDOL DERIVATIVE DAICEL CHEM IND LTD 2001-01-09 — — JP disclosed
Send feedback