SCHEMBL6856362

SCHEMBL6856362

O=C1C[N]C(=O)N1CCc1ccccn1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.59
DAO P14920 1/20 0.46
GRM5 P41594 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
PKM P14618 1/20 0.43
KMT2A Q03164 1/20 0.43
HRH3 Q9Y5N1 2/20 0.43
ACHE P22303 1/20 0.43
HRH1 P35367 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL17525607 0.78 HSD17B10 (0.62) HSD17B10DAOGRM5L3MBTL1MEN1
SCHEMBL1382465 0.75 HSD17B10 (0.57) HSD17B10DAOGRM5L3MBTL1MEN1
SCHEMBL5865442 0.75 HSD17B10 (0.57) HSD17B10DAOGRM5L3MBTL1MEN1
SCHEMBL3281437 0.74 HSD17B10 (1.00) HSD17B10DAOGRM5MEN1ALDH1A1
SCHEMBL17525771 0.73 HSD17B10 (0.51) HSD17B10DAOGRM5L3MBTL1MEN1
SCHEMBL10159126 0.72 MAPT (0.61) HSD17B10GRM5L3MBTL1MEN1ALDH1A1
SCHEMBL41923 0.70 ALDH1A1 (0.64) HSD17B10L3MBTL1MEN1ALDH1A1PKM
SCHEMBL6809288 0.70 ATAD2 (0.55) HSD17B10GRM5ACHEHRH1
SCHEMBL2135730 0.70 HSD17B10 (0.51) HSD17B10DAOL3MBTL1MEN1KMT2A
SCHEMBL6856114 0.70 HSD17B10 (0.51) HSD17B10DAOL3MBTL1HRH3ACHE

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
US-6784293-B1 SOLUTION AND SOLID-PHASE SYNTHESIS OF BOC-PROTECTED 3-AMINOHYDANTOINS/THIOHYDANTOINS AND 3-AMINODIHYDROURACILS/ DIHYDROTHIOURACILS THE PROCTER & GAMBLE COMPANY 2004-08-31 US disclosed