SCHEMBL6208719

SCHEMBL6208719

C(=NOCc1ccccc1)c1ccc2ccccc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.51
PPARA Q07869 1/20 0.51
RAB9A P51151 5/20 0.50
NPC1 O15118 3/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
GAA P10253 2/20 0.50
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALOX5 P09917 1/20 0.49
NR1I2 O75469 2/20 0.48
NR1I3 Q14994 1/20 0.48
DHODH Q02127 1/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
RELA Q04206 2/20 0.44
NAMPT P43490 1/20 0.44
GRIN2D O15399 2/20 0.44
GRIN3B O60391 2/20 0.44
GRIN1 Q05586 2/20 0.44

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
SCHEMBL6208715 1.00 PPARG (0.51) PPARGPPARARAB9ANPC1L3MBTL1
SCHEMBL10798007 0.81 NPC1 (0.70) PPARGPPARARAB9ANPC1L3MBTL1
SCHEMBL3080187 0.81 NPC1 (0.70) PPARGPPARARAB9ANPC1L3MBTL1
SCHEMBL3080186 0.81 NPC1 (0.70) PPARGPPARARAB9ANPC1L3MBTL1
SCHEMBL14353303 0.80 ALDH1A1 (0.53) L3MBTL1SMN1; SMN2GAAALDH1A1KDM4E
SCHEMBL13351487 0.80 ALDH1A1 (0.53) L3MBTL1SMN1; SMN2GAAALDH1A1KDM4E
SCHEMBL6873224 0.79 G6PC1 (0.56) PPARGPPARARAB9ANPC1L3MBTL1
SCHEMBL8109795 0.79 SMN1; SMN2 (0.64) PPARGPPARARAB9ANPC1SMN1; SMN2
SCHEMBL28114466 0.79 KMT2A (0.60) PPARGPPARARAB9ANPC1L3MBTL1
SCHEMBL8109792 0.79 SMN1; SMN2 (0.64) PPARGPPARARAB9ANPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130004979-A1 GLYCOSYLTRANSFERASE REVERSIBILITY FOR SUGAR NUCLEOTIDE SYNTHESIS AND MICROSCALE SCANNING WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2013-01-03 US disclosed
US-20130004979-A1 GLYCOSYLTRANSFERASE REVERSIBILITY FOR SUGAR NUCLEOTIDE SYNTHESIS AND MICROSCALE SCANNING WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2013-01-03 US disclosed
US-20130004979-A1 GLYCOSYLTRANSFERASE REVERSIBILITY FOR SUGAR NUCLEOTIDE SYNTHESIS AND MICROSCALE SCANNING WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2013-01-03 US disclosed
EP-1503988-A2 FREDERICAMYCIN DERIVATIVES Biofrontera Discovery Gmbh (DE) 2005-02-09 EP disclosed
WO-2003080582-A2 FREDERICAMYCIN DERIVATIVES BIOFRONTERA DISCOVERY GMBH (DE) 2003-10-02 WO disclosed