SCHEMBL9190653

SCHEMBL9190653

Nn1cc(I)c(=O)[nH]c1=O

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.57
CYP1A2 P05177 1/20 0.45
GRIA1 P42261 1/20 0.45
GRIA2 P42262 1/20 0.45
GRIA4 P48058 1/20 0.45
BLM P54132 1/20 0.45
KMT2A Q03164 1/20 0.45
GRIK5 Q16478 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TYMP P19971 8/20 0.40
CRBN Q96SW2 1/20 0.40
TK1 P04183 4/20 0.37
DPYD Q12882 1/20 0.37
PYGM P11217 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
SCHEMBL19841638 0.74 KMT2A (0.42) TDP1CYP1A2GRIA1GRIA2GRIA4
SCHEMBL646139 0.74 TDP1 (0.59) TDP1BLMTYMPCRBNTK1
SCHEMBL400005 0.73 TDP1 (1.00) TDP1CYP1A2GRIA1GRIA2GRIA4
SCHEMBL4379055 0.73 DAO (0.43) CYP1A2GRIA1GRIA2GRIA4BLM
SCHEMBL10939258 0.73 DPYD (0.41) TDP1CYP1A2GRIA1GRIA2GRIA4
SCHEMBL9192075 0.73 TDP1 (0.57) TDP1CYP1A2GRIA1GRIA2GRIA4
SCHEMBL9192590 0.73 TDP1 (0.57) TDP1CYP1A2GRIA1GRIA2GRIA4
SCHEMBL17041835 0.70 TDP1 (0.53) TDP1CYP1A2KMT2ACRBNTK1
SCHEMBL933036 0.68 TK1 (0.43) TDP1CYP1A2GRIA1GRIA2GRIA4
SCHEMBL12747301 0.68 CYP1A2 (0.41) CYP1A2GRIA1GRIA2GRIA4BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015125782-A1 METHOD FOR PRODUCING THIOLANE-SKELETON GLYCOCONJUGATE, AND THIOLANE-SKELETON GLYCOCONJUGATE 富士フイルム株式会社 2015-08-27 WO disclosed
WO-2015125781-A1 METHOD FOR PRODUCTING THIOLANE SKELETON-TYPE GLYCOCONJUGATE, AND THIOLANE SKELETON-TYPE GLYCOCONJUGATE 富士フイルム株式会社 2015-08-27 WO disclosed
EP-0425669-B1 1-AMINO-5-HALOGENOURACILS, PROCESS FOR THEIR PREPARATION, AND CENTRAL NERVOUS SYSTEM DEPRESSANTS CONTAINING SAME AS ACTIVE INGREDIENT YAMASA SHOYU KK (JP) 1995-01-25 EP disclosed
US-5334593-A Anxiolytic drugs YAMASA SHOYU KABUSHIKI KAISHA (JP) 1994-08-02 US disclosed
US-5252576-A 1-amino-5-halogenouracils, process for their preparation, and central nervous system depressants containing same as active ingredient YAMASA SHOYU KABUSHIKI KAISHA (JP) 1993-10-12 US disclosed
EP-0509098-A1 ATARACTIC Yamasa Shoyu Kabushiki Kaisha (JP) 1992-10-21 EP disclosed
EP-0425669-A1 1-AMINO-5-HALOGENOURACILS, PROCESS FOR THEIR PREPARATION, AND CENTRAL NERVOUS SYSTEM DEPRESSANTS CONTAINING SAME AS ACTIVE INGREDIENT Yamasa Shoyu Kabushiki Kaisha also trading as Yamasa Corporation (JP) 1991-05-08 EP disclosed