SCHEMBL8553566

SCHEMBL8553566

Cc1cc(C)cc(Oc2[nH]c(=O)n(COCCO)c(=O)c2C(C)C)c1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.34
PNP P00491 2/20 0.33
UPP1 Q16831 1/20 0.32

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
SCHEMBL8555615 0.89 KDM4E (0.33) HTT
SCHEMBL8393791 0.83 ALDH1A1 (0.46)
SCHEMBL8067216 0.82 PNP (0.36) HTTPNPUPP1
SCHEMBL7847745 0.81 ELANE (0.32)
SCHEMBL7848800 0.80 KDM4E (0.34) HTT
SCHEMBL7846207 0.77 TLR7 (0.42) HTT
SCHEMBL7844254 0.76 LMNA (0.33)
SCHEMBL8530296 0.76 GRIN1 (0.35)
SCHEMBL7843323 0.76 GRIN1 (0.36)
SCHEMBL7848233 0.76 MTNR1A (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0912526-A1 ANTIVIRAL 2,4-PYRIMIDINEDIONE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Korea Research Institute of Chemical Technology (KR) 1999-05-06 EP disclosed
WO-1997043266-A1 ANTIVIRAL 2,4-PYRIMIDINEDIONE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1997-11-20 WO disclosed