SCHEMBL8760742

SCHEMBL8760742

CC(C)c1c(-c2ccccc2)n(COCCO)c(=O)[nH]c1=O

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
UPP1 Q16831 1/20 0.48
ALDH1A1 P00352 1/20 0.39
PNP P00491 2/20 0.37
MET P08581 1/20 0.36
POLB P06746 1/20 0.36
HPGD P15428 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL8760939 0.88 UPP1 (0.39) UPP1ALDH1A1PNP
SCHEMBL8427021 0.81 UPP1 (0.46) UPP1ALDH1A1PNPPOLBHPGD
SCHEMBL8760732 0.81 UPP1 (0.46) UPP1ALDH1A1PNPPOLBHPGD
SCHEMBL8427063 0.76 MEN1 (0.34) UPP1ALDH1A1PNPPOLBMEN1
SCHEMBL8760250 0.74 SIRT2 (0.47) UPP1ALDH1A1POLB
SCHEMBL29184178 0.73 UPP1 (0.42) UPP1ALDH1A1
SCHEMBL5572945 0.72 UPP1 (0.41) UPP1ALDH1A1PNP
SCHEMBL9354043 0.72 UPP1 (0.39) UPP1ALDH1A1
SCHEMBL8428848 0.72 UPP1 (0.37) UPP1ALDH1A1PNPPOLBHPGD
SCHEMBL8760934 0.72 UPP1 (0.37) UPP1ALDH1A1PNPPOLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0449726-B1 Pyrimidine nucleoside derivative and antiviral agent containing the derivative as active ingredient MITSUBISHI CHEM CORP (JP) 1997-06-11 EP claimed
US-5318972-A Active against retroviruses, human t-cell leukemia/lymphoma viruses MITSUBISHI KASEI CORPORATION (JP) 1994-06-07 US claimed
EP-0449726-A1 Pyrimidine nucleoside derivative and antiviral agent containing the derivative as active ingredient Mitsubishi Chemical Corporation (JP) 1991-10-02 EP claimed
JP-3284624-A None JP disclosed
EP-0449726-B1 Pyrimidine nucleoside derivative and antiviral agent containing the derivative as active ingredient MITSUBISHI CHEM CORP (JP) 1997-06-11 EP disclosed
US-5318972-A Active against retroviruses, human t-cell leukemia/lymphoma viruses MITSUBISHI KASEI CORPORATION (JP) 1994-06-07 US disclosed
JP-H03284624-A ANTIVIRAL AGENT MITSUBISHI KASEI CORP 1991-12-16 JP disclosed
EP-0449726-A1 Pyrimidine nucleoside derivative and antiviral agent containing the derivative as active ingredient Mitsubishi Chemical Corporation (JP) 1991-10-02 EP disclosed