SCHEMBL4577256

SCHEMBL4577256

CCCCOc1nc(N)c2[nH]c(=O)n(C(C)C3CCN(C(C(N)=O)c4cccc(CC(=O)OC)c4)CC3)c2n1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.60
IL6 P05231 1/20 0.43

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
SCHEMBL4576568 0.95 TLR7 (0.58) TLR7
SCHEMBL4577248 0.89 TLR7 (0.63) TLR7
SCHEMBL4591269 0.89 TLR7 (0.50) TLR7
SCHEMBL4577593 0.85 TLR7 (0.60) TLR7
SCHEMBL4898758 0.83 TLR7 (0.59) TLR7IL6
SCHEMBL4578104 0.81 TLR7 (0.56) TLR7
SCHEMBL4578268 0.79 TLR7 (0.59) TLR7
SCHEMBL4576582 0.78 TLR7 (0.58) TLR7IL6
SCHEMBL4576840 0.78 TLR7 (0.58) TLR7
SCHEMBL4577549 0.78 TLR7 (0.51) TLR7IL6

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-1939199-A1 NOVEL ADENINE COMPOUND Dainippon Sumitomo Pharma Co., Ltd. (JP) 2008-07-02 EP disclosed