SCHEMBL12464622

SCHEMBL12464622

OC[C@H]1O[C@@H](c2ccc3c4cccc5cccc(c6cccc2c63)c54)CC1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GALR3 O60755 1/20 0.36
NR2F2 P24468 1/20 0.36
NCOA1 Q15788 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
PDE4D Q08499 1/20 0.32
OGA O60502 1/20 0.32
PYGL P06737 1/20 0.32
PTPN1 P18031 1/20 0.32
CD209 Q9NNX6 1/20 0.31
ADRB1 P08588 1/20 0.31
DNMT1 P26358 1/20 0.31
ADK P55263 1/20 0.31
SLC5A2 P31639 1/20 0.31
LGALS9 O00182 1/20 0.31
LGALS8 O00214 1/20 0.31
LGALS1 P09382 1/20 0.31
LGALS3 P17931 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
SCHEMBL14088837 1.00 GALR3 (0.36) GALR3NR2F2NCOA1NCOA3SLC6A2
SCHEMBL18025723 1.00 GALR3 (0.36) GALR3NR2F2NCOA1NCOA3SLC6A2
SCHEMBL14211494 1.00 GALR3 (0.36) GALR3NR2F2NCOA1NCOA3SLC6A2
SCHEMBL24687116 0.90 GALR3 (0.36) GALR3NR2F2NCOA1NCOA3PDE4D
SCHEMBL22334100 0.90 GALR3 (0.36) GALR3NR2F2NCOA1NCOA3PDE4D
SCHEMBL12464627 0.90 GALR3 (0.36) GALR3NR2F2NCOA1NCOA3PDE4D
SCHEMBL14211493 0.90 GALR3 (0.36) GALR3NR2F2NCOA1NCOA3PDE4D
SCHEMBL5048342 0.90 GALR3 (0.36) GALR3NR2F2NCOA1NCOA3PDE4D
SCHEMBL15255719 0.90 GALR3 (0.36) GALR3NR2F2NCOA1NCOA3PDE4D
SCHEMBL12766796 0.90 GALR3 (0.36) GALR3NR2F2NCOA1NCOA3PDE4D

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-2011081939-A1 DIRECT SENSING OF MOLECULAR SPECIES BY POLYFLUORS ON A DNA BACKBONE THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2011-07-07 WO disclosed