SCHEMBL6659183

SCHEMBL6659183

OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.51
PDE4D Q08499 1/20 0.46
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
TACR2 P21452 1/20 0.43
PDPK1 O15530 2/20 0.43
MTOR P42345 1/20 0.43
LGALS8 O00214 1/20 0.42
HRAS P01112 2/20 0.40
SLC5A2 P31639 2/20 0.40
BCHE P06276 1/20 0.39
GJB2 P29033 1/20 0.39

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
SCHEMBL969972 1.00 SLC6A2 (0.51) SLC6A2PDE4DTSHRCYP2C19TACR2
SCHEMBL969974 1.00 SLC6A2 (0.51) SLC6A2PDE4DTSHRCYP2C19TACR2
SCHEMBL630301 1.00 SLC6A2 (0.51) SLC6A2PDE4DTSHRCYP2C19TACR2
SCHEMBL8960128 0.95 SLC6A2 (0.52) SLC6A2PDE4DTSHRCYP2C19TACR2
SCHEMBL8960525 0.95 SLC6A2 (0.52) SLC6A2PDE4DTSHRCYP2C19TACR2
SCHEMBL8960125 0.95 SLC6A2 (0.52) SLC6A2PDE4DTSHRCYP2C19TACR2
SCHEMBL8960350 0.95 SLC6A2 (0.52) SLC6A2PDE4DTSHRCYP2C19TACR2
SCHEMBL8960222 0.95 SLC6A2 (0.52) SLC6A2PDE4DTSHRCYP2C19TACR2
SCHEMBL8960215 0.95 SLC6A2 (0.52) SLC6A2PDE4DTSHRCYP2C19TACR2
SCHEMBL6552387 0.92 SLC6A2 (0.50) SLC6A2PDE4DTSHRCYP2C19TACR2

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
EP-0730601-B1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT AND PROPHYLAXIS OF BACTERIAL INFECTIONS UNIV WASHINGTON (US) 2004-07-14 EP claimed
WO-1995014028-A9 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT AND PROPHYLAXIS OF BACTERIAL INFECTIONS 1995-08-10 WO disclosed