SCHEMBL7944601

SCHEMBL7944601

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

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CD209 Q9NNX6 1/20 0.41
SLC28A3 Q9HAS3 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TYR P14679 1/20 0.36
CASP1 P29466 1/20 0.36
CASP3 P42574 1/20 0.36
CASP7 P55210 1/20 0.36
CASP6 P55212 1/20 0.36
CASP8 Q14790 1/20 0.36
EPHX2 P34913 1/20 0.36
SLC5A2 P31639 2/20 0.35
ATM Q13315 1/20 0.35
PYGL P06737 1/20 0.35
SLC5A1 P13866 1/20 0.35

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
SCHEMBL6844264 1.00 CD209 (0.41) CD209SLC28A3KDM4EALDH1A1LMNA
SCHEMBL7944608 0.86 CD209 (0.53) CD209SLC28A3TYREPHX2SLC5A2
SCHEMBL7944605 0.86 CD209 (0.53) CD209SLC28A3TYREPHX2SLC5A2
SCHEMBL2541155 0.85 CD209 (0.54) CD209SLC28A3POLBEPHX2SLC5A2
SCHEMBL14974651 0.85 CD209 (0.54) CD209SLC28A3POLBEPHX2SLC5A2
SCHEMBL1378655 0.85 CD209 (0.54) CD209SLC28A3POLBEPHX2SLC5A2
SCHEMBL11121957 0.85 CD209 (0.54) CD209SLC28A3POLBEPHX2SLC5A2
SCHEMBL22125691 0.85 CD209 (0.54) CD209SLC28A3POLBEPHX2SLC5A2
SCHEMBL7747632 0.85 CD209 (0.54) CD209SLC28A3POLBEPHX2SLC5A2
SCHEMBL9013945 0.85 CD209 (0.54) CD209SLC28A3POLBEPHX2SLC5A2

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