SCHEMBL8288666

SCHEMBL8288666

CSCCC(=O)Nc1sc2c(c1C(N)=O)CCCCC2

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 5/20 0.69
HPGD P15428 4/20 0.69
LMNA P02545 3/20 0.69
ALDH1A1 P00352 5/20 0.67
MEN1 O00255 3/20 0.67
KMT2A Q03164 3/20 0.67
RAB9A P51151 1/20 0.67
MAPK10 P53779 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
KDM4E B2RXH2 2/20 0.65
MAPK1 P28482 1/20 0.65
TSHR P16473 4/20 0.62
MAPT P10636 3/20 0.62
GFER P55789 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP2C19 P33261 1/20 0.62
HSD17B10 Q99714 2/20 0.62
ALOX15 P16050 1/20 0.62
ANO1 Q5XXA6 1/20 0.60

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
SCHEMBL8288828 0.99 FLT3 (0.70) FLT3HPGDLMNAALDH1A1MEN1
SCHEMBL8289868 0.96 ALDH1A1 (0.72) FLT3HPGDLMNAALDH1A1MEN1
SCHEMBL5465217 0.85 ALDH1A1 (0.81) FLT3HPGDLMNAALDH1A1MEN1
SCHEMBL4135422 0.84 HPGD (0.83) FLT3HPGDLMNAALDH1A1MEN1
SCHEMBL8288697 0.83 ALDH1A1 (0.86) FLT3HPGDLMNAALDH1A1MEN1
SCHEMBL5454380 0.82 FLT3 (0.72) FLT3HPGDLMNAALDH1A1MEN1
SCHEMBL5457782 0.82 ALDH1A1 (0.95) FLT3HPGDLMNAALDH1A1MEN1
SCHEMBL3453230 0.82 FLT3 (0.71) FLT3HPGDLMNAALDH1A1MEN1
SCHEMBL5455950 0.82 HPGD (0.83) FLT3HPGDLMNAALDH1A1MEN1
SCHEMBL8288679 0.82 HPGD (0.78) FLT3HPGDLMNAALDH1A1MEN1

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-2005033102-A2 THIOPHENE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF AMPHORA DISCOVERY CORPORATION (US) 2005-04-14 WO disclosed