SCHEMBL5794958

SCHEMBL5794958

CC(=O)Nc1ccc2c(c1)SC(Cc1ccccc1)C(=O)N2CC(=O)ON

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.42
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
TSHR P16473 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
LMNA P02545 2/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.37
THRB P10828 1/20 0.37
MCL1 Q07820 1/20 0.36
NQO2 P16083 1/20 0.36
POLB P06746 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
Hydroxyamine SCHEMBL5794953 0.89 RAB9A (0.43) PPARGRAB9ASMN1; SMN2TSHRL3MBTL1
SCHEMBL6841912 0.87 RAB9A (0.45) RAB9ASMN1; SMN2TSHRL3MBTL1LMNA
SCHEMBL5794208 0.81 PPARG (0.43) PPARGLMNAHTTMCL1POLB
SCHEMBL6847480 0.77 PPARG (0.54) PPARGSMN1; SMN2TSHRL3MBTL1LMNA
SCHEMBL5793022 0.75 PPARG (0.48) PPARGSMN1; SMN2TSHRL3MBTL1LMNA
SCHEMBL5747345 0.70 PPARG (0.54) PPARGSMN1; SMN2LMNAHTTMCL1
SCHEMBL5798279 0.69 PPARG (0.46) PPARGRAB9ASMN1; SMN2LMNAHTT
SCHEMBL6847542 0.69 BMP1 (0.40) PPARGTSHRLMNAHTTMCL1
SCHEMBL7508298 0.67 ATM (0.36) PPARGRAB9ASMN1; SMN2TSHRLMNA
Hydroxyamine SCHEMBL5793019 0.66 MCL1 (0.51) PPARGSMN1; SMN2TSHRL3MBTL1LMNA

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
EP-1173427-B1 HYDROXAMIC ACID DERIVATIVE DAINIPPON SUMITOMO PHARMA CO (JP) 2006-04-05 EP disclosed