SCHEMBL7213283

SCHEMBL7213283

CCOCn1cc(I)c(=O)[nH]c1=O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
CYP1A2 P05177 2/20 0.48
GRIA1 P42261 1/20 0.48
GRIA2 P42262 1/20 0.48
GRIA4 P48058 1/20 0.48
BLM P54132 1/20 0.48
GRIK5 Q16478 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TYMP P19971 4/20 0.39
UPP1 Q16831 1/20 0.37
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.35
TK1 P04183 2/20 0.35
HPGD P15428 1/20 0.34
MAPT P10636 1/20 0.34
CYP2C9 P11712 1/20 0.34
GAA P10253 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL7213472 0.81 UPP1 (0.47) UPP1LMNAMAPK1TK1
SCHEMBL7219926 0.81 MAPK1 (0.54) TYMPMAPK1TK1HPGD
SCHEMBL1834796 0.80 UPP1 (0.57) KMT2ACYP1A2GRIA1GRIA2GRIA4
SCHEMBL6372044 0.79 LMNA (0.56) KMT2ACYP1A2GRIA1GRIA2GRIA4
SCHEMBL13321360 0.79 CYP1A2 (0.48) KMT2ACYP1A2GRIA1GRIA2GRIA4
SCHEMBL1287949 0.77 HTT (0.36) KMT2ACYP1A2GRIA1GRIA2GRIA4
SCHEMBL7219565 0.76 TK2 (0.41) CYP1A2BLMUPP1MAPK1TK1
SCHEMBL7219562 0.76 TK2 (0.41) CYP1A2BLMUPP1MAPK1TK1
SCHEMBL9885886 0.76 HPGD (0.35) KMT2ACYP1A2UPP1LMNAMAPK1
SCHEMBL11370922 0.76 KMT2A (0.62) KMT2AHSD17B10UPP1LMNAMAPK1

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-RE37979-E1 Pyrimidine derivatives and anti-viral agent containing the same as active ingredient thereof MITSUBISHI CHEMICAL CORPORATION 2003-02-04 US disclosed
EP-0829476-B1 6-Substituted acyclopyrimidine nucleoside derivatives and antiviral agent containing the same as active ingredient thereof MITSUBISHI CHEM CORP (JP) 2002-08-28 EP disclosed
EP-0829476-A2 6-Substituted acyclopyrimidine nucleoside derivatives and antiviral agent containing the same as active ingredient thereof Mitsubishi Chemical Corporation (JP) 1998-03-18 EP disclosed
US-5461060-A Antiretroviral activity MITSUBISHI KASEI CORPORATION (JP) 1995-10-24 US disclosed
EP-0420763-A2 6-Substituted acyclopyrimidine nucleoside derivatives and antiviral agent containing the same as active ingredient thereof Mitsubishi Chemical Corporation (JP) 1991-04-03 EP disclosed