SCHEMBL5314758

SCHEMBL5314758

O=C(O)CCC1SCCCS1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.43
LMNA P02545 5/20 0.36
TDP1 Q9NUW8 4/20 0.36
HSD17B10 Q99714 2/20 0.36
ALDH1A1 P00352 2/20 0.36
TSHR P16473 2/20 0.36
PMP22 Q01453 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
CYP2C9 P11712 1/20 0.36
NR1I2 O75469 1/20 0.36
POLB P06746 1/20 0.36
THRB P10828 1/20 0.36
ACHE P22303 1/20 0.36
APEX1 P27695 1/20 0.36
RECQL P46063 1/20 0.36
BLM P54132 1/20 0.36
SAE1 Q9UBE0 1/20 0.36
UBA2 Q9UBT2 1/20 0.36

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
SCHEMBL8531514 0.91 FOLH1 (0.41) FOLH1LMNATDP1HSD17B10ALDH1A1
SCHEMBL15757375 0.85 LMNA (0.49) LMNATDP1HSD17B10ALDH1A1TSHR
SCHEMBL343431 0.80 TSHR (0.32) ALDH1A1TSHRFAAH
SCHEMBL5231959 0.77 LMNA (0.44) LMNATDP1HSD17B10ALDH1A1TSHR
SCHEMBL3047626 0.76 FAAH (0.37) TSHRFAAH
SCHEMBL8400937 0.76 LMNA (0.52) FOLH1LMNATDP1HSD17B10ALDH1A1
SCHEMBL7939245 0.67
SCHEMBL1695048 0.67 CYP2D6 (0.40) FAAH
SCHEMBL24003308 0.66 LMNA (0.59) FOLH1LMNATDP1HSD17B10ALDH1A1
SCHEMBL7428860 0.65

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-2007053869-A2 NOVEL 2,2-DITHIOSUBSTITUTED FURANOSE DERIVATIVES, METHOD FOR THE PRODUCTION AND USE THEREOF SAISCHEK UND PARTNER MEG (AT) 2007-05-18 WO disclosed