SCHEMBL7944608

SCHEMBL7944608

OC[C@H]1O[C@H](Oc2cccc3cc(Br)ccc23)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CD209 Q9NNX6 1/20 0.53
SLC28A3 Q9HAS3 2/20 0.51
TYR P14679 2/20 0.50
EPHX2 P34913 1/20 0.50
ATM Q13315 1/20 0.49
HIF1A Q16665 1/20 0.47
SLC5A2 P31639 4/20 0.47
ACHE P22303 1/20 0.46
SLC5A1 P13866 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL7944605 1.00 CD209 (0.53) CD209SLC28A3TYREPHX2ATM
SCHEMBL9614820 0.90 CD209 (0.53) CD209SLC28A3TYREPHX2ATM
SCHEMBL6844264 0.86 CD209 (0.41) CD209SLC28A3TYREPHX2ATM
SCHEMBL7944601 0.86 CD209 (0.41) CD209SLC28A3TYREPHX2ATM
SCHEMBL23479818 0.84 CD209 (0.70) CD209SLC28A3TYREPHX2ATM
SCHEMBL8654258 0.84 CD209 (0.70) CD209SLC28A3TYREPHX2ATM
SCHEMBL4609196 0.84 CD209 (0.70) CD209SLC28A3TYREPHX2ATM
SCHEMBL869516 0.84 CD209 (0.70) CD209SLC28A3TYREPHX2ATM
SCHEMBL1004201 0.84 CD209 (0.70) CD209SLC28A3TYREPHX2ATM
SCHEMBL3742958 0.84 CD209 (0.70) CD209SLC28A3TYREPHX2ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1080204-A2 BETA-GLUCOSIDASE CODING SEQUENCES AND PROTEIN FROM ORPINOMYCES PC-2 University of Georgia Research Foundation, Inc. (US) 2001-03-07 EP disclosed
US-6184018-B1 NUCLEOTIDE SEQUENCES CODING FUNGAL ENZYMATIC POLYPEPTIDE; FOR EFFICIENT SACCHARIFICATION OF CELLULOSIC MATERIALS UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. 2001-02-06 US disclosed
WO-1999057287-A2 BETA-GLUCOSIDASE CODING SEQUENCES AND PROTEIN FROM ORPINOMYCES PC-2 UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 1999-11-11 WO disclosed