SCHEMBL13059617

SCHEMBL13059617

COC(=O)CC(C)(O)CC(C)(C)Br

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.37
HSD17B10 Q99714 3/20 0.34
GAA P10253 2/20 0.34
HMGCR P04035 1/20 0.34
CHRM1 P11229 1/20 0.34
TBXA2R P21731 1/20 0.34
ADRA1A P35348 1/20 0.34
MGAM O43451 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
TET2 Q6N021 1/20 0.33
RECQL P46063 2/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
LMNA P02545 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
USP2 O75604 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
SCHEMBL13059616 0.83 TSHR (0.40) TSHRHSD17B10GAAHMGCRCHRM1
SCHEMBL7047649 0.82 HMGCR (0.50) TSHRHSD17B10GAAHMGCRCHRM1
SCHEMBL18903926 0.81 TSHR (0.39) TSHRHSD17B10GAAMGAMSI
SCHEMBL12900985 0.80
SCHEMBL13059619 0.79 TSHR (0.37) TSHRHSD17B10GAAHMGCRCHRM1
SCHEMBL18751330 0.76 TSHR (0.42) TSHRHSD17B10GAAHMGCRCHRM1
SCHEMBL10767936 0.75 TSHR (0.37) TSHRHSD17B10GAAHMGCRCHRM1
SCHEMBL9913733 0.74 MGAM (0.48) TSHRHSD17B10GAAHMGCRCHRM1
SCHEMBL17301670 0.74 MGAM (0.48) TSHRHSD17B10GAAHMGCRCHRM1
SCHEMBL15944462 0.74 HMGCR (0.68) TSHRHSD17B10GAAHMGCRCHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7842687-B2 Natural, synthetic or semi-synthetic crude harringtonines purified by chromatography and crystallization in which the solvent is water or lower C1-4 alkanol or an aqueous mixture of organic solvents; treatment of cancer through oral administration CHEMGENEX PHARMACEUTICALS, INC. (AU) 2010-11-30 US disclosed
US-7169774-B2 Cephalotaxane derivatives and their processes of preparation and purification STRAGEN PHARMA S.A. (CH) 2007-01-30 US disclosed