SCHEMBL8587208

SCHEMBL8587208

OC[C@H](O)[C@H](O)[C@H](O)COC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TK1 P04183 2/20 0.44
KIF11 P52732 3/20 0.42
DUT P33316 1/20 0.39
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
LMNA P02545 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
MAPT P10636 2/20 0.35
MAPK1 P28482 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CTSK P43235 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.32
GAA P10253 1/20 0.32
HRH4 Q9H3N8 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
SCHEMBL10438660 0.97 TK1 (0.44) TK1KIF11DUTCYP2C9CYP2C19
SCHEMBL6516985 0.89 TK1 (0.48) TK1KIF11DUTCYP2C9CYP2C19
SCHEMBL24587233 0.89 TK1 (0.48) TK1KIF11DUTCYP2C9CYP2C19
SCHEMBL5322323 0.88 TK1 (0.39) TK1KIF11DUTLMNASMN1; SMN2
SCHEMBL10772460 0.85 TK1 (0.54) TK1KIF11DUTCYP2C9CYP2C19
SCHEMBL20608703 0.84 KIF11 (0.41) TK1KIF11DUTCYP2C9CYP2C19
SCHEMBL19066253 0.84 KIF11 (0.41) TK1KIF11DUTCYP2C9CYP2C19
SCHEMBL19668110 0.84 KIF11 (0.41) TK1KIF11DUTCYP2C9CYP2C19
SCHEMBL19668111 0.84 KIF11 (0.41) TK1KIF11DUTCYP2C9CYP2C19
SCHEMBL6522822 0.80 TK1 (0.46) TK1KIF11DUTCYP2C9CYP2C19

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
WO-1998039347-A2 SYNTHESIS OF L-RIBOSE AND 2-DEOXY L-RIBOSE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1998-09-11 WO disclosed