SCHEMBL7899424

SCHEMBL7899424

C[C@H]1O[C@H](OCc2ccccc2)[C@H](F)[C@@H](OCc2ccccc2)[C@H]1N

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 2/20 0.37
SSTR1 P30872 1/20 0.37
SSTR2 P30874 1/20 0.37
SSTR4 P31391 1/20 0.37
SSTR3 P32745 1/20 0.37
GJB2 P29033 2/20 0.37
FGF1 P05230 2/20 0.37
FGF2 P09038 2/20 0.37
VEGFA P15692 2/20 0.37
HPSE Q9Y251 2/20 0.37
PDPK1 O15530 1/20 0.36
MTOR P42345 1/20 0.36
BCHE P06276 2/20 0.33
PDE2A O00408 1/20 0.33
SLC6A2 P23975 1/20 0.33
IDO1 P14902 1/20 0.33
HRAS P01112 1/20 0.32
ACHE P22303 1/20 0.32

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
SCHEMBL7899420 1.00 SSTR5 (0.37) SSTR5SSTR1SSTR2SSTR4SSTR3
SCHEMBL7899774 0.87 PDPK1 (0.39) SSTR5SSTR1SSTR2SSTR4SSTR3
SCHEMBL7899770 0.83 SLC6A2 (0.40) SSTR5SSTR1SSTR2SSTR4SSTR3
SCHEMBL15504387 0.80 PDPK1 (0.44) SSTR5SSTR1SSTR2SSTR4SSTR3
SCHEMBL15504452 0.80 PDPK1 (0.44) SSTR5SSTR1SSTR2SSTR4SSTR3
SCHEMBL7899767 0.78 TOP2A (0.39) SSTR5PDPK1MTORSLC6A2IDO1
SCHEMBL7899771 0.78 TOP2A (0.39) SSTR5PDPK1MTORSLC6A2IDO1
SCHEMBL9503684 0.78 SSTR1 (0.42) SSTR5SSTR1SSTR2SSTR4SSTR3
SCHEMBL7892063 0.78 SSTR1 (0.42) SSTR5SSTR1SSTR2SSTR4SSTR3
SCHEMBL26349596 0.77 SSTR5 (0.39) SSTR5SSTR1SSTR2SSTR4SSTR3

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
US-6184365-B1 3,4-DI-O,N-PROTECTED-4-AMINO-2,4,6-TRIDEOXY-2-FLUORO-L-TALOPYR ANOSYL IODIDE OR BROMIDE; CHEMICAL INTERMEDIATES FOR PRODUCTION OF NOVEL DAUNOMYCINONE OR ADRIAMYCINONE DERIVATIVES ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 2001-02-06 US claimed
US-6184365-B1 3,4-DI-O,N-PROTECTED-4-AMINO-2,4,6-TRIDEOXY-2-FLUORO-L-TALOPYR ANOSYL IODIDE OR BROMIDE; CHEMICAL INTERMEDIATES FOR PRODUCTION OF NOVEL DAUNOMYCINONE OR ADRIAMYCINONE DERIVATIVES ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 2001-02-06 US disclosed
EP-0848010-A1 Novel anthracycline derivatives having 4-amino-2,4,6-trideoxy-2-fluoro-alpha-L-talopyranosyl group ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1998-06-17 EP disclosed