SCHEMBL730314

SCHEMBL730314

S=C(NC(=S)Nc1ccccc1)Nc1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.80
TAS2R38 P59533 3/20 0.80
HSD17B10 Q99714 2/20 0.80
CYP3A4 P08684 1/20 0.80
GAA P10253 7/20 0.73
KMT2A Q03164 5/20 0.73
MEN1 O00255 3/20 0.73
RAB9A P51151 3/20 0.73
NPC1 O15118 2/20 0.73
NOX1 Q9Y5S8 2/20 0.73
EPHX1 P07099 2/20 0.69
TP53 P04637 1/20 0.65
TYR P14679 1/20 0.65
TSHR P16473 1/20 0.65
MAOA P21397 2/20 0.64
MAOB P27338 2/20 0.64
LMNA P02545 2/20 0.64
MAPT P10636 3/20 0.61
SMN1; SMN2 Q16637 2/20 0.57
KDM4E B2RXH2 1/20 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
SCHEMBL132620 0.89 ALDH1A1 (1.00) ALDH1A1TAS2R38HSD17B10CYP3A4GAA
SCHEMBL9470190 0.86 ALDH1A1 (0.94) ALDH1A1TAS2R38HSD17B10CYP3A4GAA
SCHEMBL8956322 0.86 ALDH1A1 (0.94) ALDH1A1TAS2R38HSD17B10CYP3A4GAA
SCHEMBL23728134 0.86 EPHX1 (0.71) ALDH1A1TAS2R38HSD17B10CYP3A4GAA
SCHEMBL2316198 0.86 ALDH1A1 (0.75) ALDH1A1TAS2R38HSD17B10CYP3A4GAA
SCHEMBL20174110 0.84 EPHX1 (0.67) ALDH1A1TAS2R38HSD17B10CYP3A4GAA
SCHEMBL19139215 0.84 ALDH1A1 (0.64) ALDH1A1TAS2R38HSD17B10CYP3A4GAA
SCHEMBL30741213 0.84 MAPT (0.61) ALDH1A1TAS2R38HSD17B10CYP3A4GAA
SCHEMBL3083065 0.83 EPHX1 (0.67) ALDH1A1TAS2R38HSD17B10CYP3A4GAA
SCHEMBL11763947 0.83 EPHX1 (0.67) ALDH1A1TAS2R38HSD17B10CYP3A4GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2124934-A2 COSMETIC AND PHARMACEUTICAL APPLICATIONS OF N-ACETYLHYDROXYPROLINE Beiersdorf AG (DE) 2009-12-02 EP claimed
EP-2117536-A2 COSMETIC AND PHARMACEUTICAL APPLICATIONS OF N-ACYLATED AMINO ACIDS AND STRUCTURALLY RELATED COMPOUNDS Beiersdorf AG (DE) 2009-11-18 EP claimed
WO-2008101692-A2 COSMETIC AND PHARMACEUTICAL APPLICATIONS OF N-ACETYLHYDROXYPROLINE BEIERSDORF AG (DE) 2008-08-28 WO claimed
WO-2008101693-A2 COSMETIC AND PHARMACEUTICAL APPLICATIONS OF N-ACYLATED AMINO ACIDS AND STRUCTURALLY RELATED COMPOUNDS BEIERSDORF AG (DE) 2008-08-28 WO claimed
US-9711824-B2 Secondary battery and method for charging and discharging secondary battery MURATA MANUFACTURING CO., LTD. (JP) 2017-07-18 US disclosed
US-9711824-B2 Secondary battery and method for charging and discharging secondary battery MURATA MANUFACTURING CO., LTD. (JP) 2017-07-18 US disclosed
EP-2946779-A1 COSMETIC AND PHARMACEUTICAL APPLICATIONS OF N-ACETYLHYDROXYPROLINE Beiersdorf AG (DE) 2015-11-25 EP disclosed
EP-2932958-A1 COSMETIC AND PHARMACEUTICAL APPLICATIONS OF N-ACETYLHYDROXYPROLINE Beiersdorf AG (DE) 2015-10-21 EP disclosed
US-20150263387-A1 SECONDARY BATTERY AND METHOD FOR CHARGING AND DISCHARGING SECONDARY BATTERY CARLIT CO., LTD. (JP) 2015-09-17 US disclosed
US-20150263387-A1 SECONDARY BATTERY AND METHOD FOR CHARGING AND DISCHARGING SECONDARY BATTERY CARLIT CO., LTD. (JP) 2015-09-17 US disclosed
US-20150243992-A1 SECONDARY BATTERY AND METHOD FOR PRODUCING SECONDARY BATTERY MURATA MANUFACTURING CO., LTD. (JP) 2015-08-27 US disclosed
US-20150243992-A1 SECONDARY BATTERY AND METHOD FOR PRODUCING SECONDARY BATTERY MURATA MANUFACTURING CO., LTD. (JP) 2015-08-27 US disclosed
US-20150132667-A1 Secondary Battery MURATA MANUFACTURING CO., LTD. (JP) 2015-05-14 US disclosed
US-20150132667-A1 Secondary Battery MURATA MANUFACTURING CO., LTD. (JP) 2015-05-14 US disclosed
WO-2011152471-A2 RECHARGEABLE BATTERY, FUNCTIONAL POLYMER, AND METHOD FOR SYNTHESIS THEREOF 株式会社ポリチオン (JP) 2011-12-08 WO disclosed
EP-2124934-A2 COSMETIC AND PHARMACEUTICAL APPLICATIONS OF N-ACETYLHYDROXYPROLINE Beiersdorf AG (DE) 2009-12-02 EP disclosed
EP-2117536-A2 COSMETIC AND PHARMACEUTICAL APPLICATIONS OF N-ACYLATED AMINO ACIDS AND STRUCTURALLY RELATED COMPOUNDS Beiersdorf AG (DE) 2009-11-18 EP disclosed
WO-2008101692-A2 COSMETIC AND PHARMACEUTICAL APPLICATIONS OF N-ACETYLHYDROXYPROLINE BEIERSDORF AG (DE) 2008-08-28 WO disclosed
WO-2008101693-A2 COSMETIC AND PHARMACEUTICAL APPLICATIONS OF N-ACYLATED AMINO ACIDS AND STRUCTURALLY RELATED COMPOUNDS BEIERSDORF AG (DE) 2008-08-28 WO disclosed