SCHEMBL9851436

SCHEMBL9851436

Cc1c(Sc2cc(Cl)cc(Cl)c2)n(COCCO)c(=O)[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
UPP1 Q16831 1/20 0.37
HTT P42858 1/20 0.34
PNP P00491 2/20 0.33

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
SCHEMBL9353768 0.89 UPP1 (0.39) UPP1
SCHEMBL8760134 0.87 UPP1 (0.38) UPP1PNP
Hept SCHEMBL384288 0.84 UPP1 (0.48) UPP1PNP
SCHEMBL2789609 0.82 UPP1 (0.40) UPP1
SCHEMBL9357959 0.81 UPP1 (0.39) UPP1HTTPNP
SCHEMBL9353681 0.80 HPGD (0.38) UPP1PNP
SCHEMBL9353642 0.80 DHFR (0.41) UPP1
SCHEMBL9353855 0.77 SMN1; SMN2 (0.38) UPP1
SCHEMBL8760930 0.76 UPP1 (0.38) UPP1HTT
SCHEMBL8760861 0.76 GAA (0.32) UPP1HTTPNP

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
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