SCHEMBL5804228

SCHEMBL5804228

NC(=O)c1c(NC(=O)CCCC[C]=O)sc2c1CCCC2

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.71
LMNA P02545 2/20 0.71
ALDH1A1 P00352 7/20 0.69
KMT2A Q03164 3/20 0.69
MEN1 O00255 2/20 0.69
RAB9A P51151 1/20 0.69
MAPK10 P53779 1/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
TSHR P16473 4/20 0.65
MAPT P10636 4/20 0.65
GFER P55789 1/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
FLT3 P36888 6/20 0.64
KDM4E B2RXH2 2/20 0.60
MAPK1 P28482 1/20 0.60
TP53 P04637 1/20 0.60
GAA P10253 1/20 0.59
CYP1A2 P05177 1/20 0.57
CYP2C19 P33261 1/20 0.57
HSD17B10 Q99714 2/20 0.57

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
SCHEMBL4135422 0.91 HPGD (0.83) HPGDLMNAALDH1A1KMT2AMEN1
SCHEMBL3125764 0.85 ALDH1A1 (0.88) HPGDLMNAALDH1A1KMT2AMEN1
SCHEMBL8288697 0.84 ALDH1A1 (0.86) HPGDLMNAALDH1A1KMT2AMEN1
SCHEMBL5457782 0.84 ALDH1A1 (0.95) HPGDLMNAALDH1A1KMT2AMEN1
SCHEMBL5804235 0.83 HPGD (0.71) HPGDLMNAALDH1A1KMT2AMEN1
SCHEMBL8288672 0.83 ALDH1A1 (0.93) HPGDLMNAALDH1A1KMT2AMEN1
SCHEMBL8288688 0.82 ALDH1A1 (0.91) HPGDLMNAALDH1A1KMT2AMEN1
SCHEMBL8289669 0.82 HPGD (0.76) HPGDLMNAALDH1A1KMT2AMEN1
SCHEMBL5465217 0.81 ALDH1A1 (0.81) HPGDLMNAALDH1A1KMT2AMEN1
SCHEMBL5455950 0.81 HPGD (0.83) HPGDLMNAALDH1A1KMT2AMEN1

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-2006093518-A2 THIENYL COMPOUNDS FOR TREATING VIRUS-RELATED CONDITIONS APATH, LLC (US) 2006-09-08 WO disclosed