SCHEMBL6940669

SCHEMBL6940669

Cn1cc(CCC[C@@H](O[Si](C)(C)C(C)(C)C)n2cnc(C(N)=O)c2)c2cc(O)ccc21

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADA P00813 14/20 0.52
SPR P35270 1/20 0.40
CYP19A1 P11511 1/20 0.34
HTR6 P50406 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
SCHEMBL6935339 0.89 ADA (0.51) ADA
SCHEMBL6938186 0.88 ADA (0.62) ADAHTR6
SCHEMBL6938860 0.87 ADA (0.72) ADA
SCHEMBL6935340 0.85 ADA (0.72) ADA
SCHEMBL6942584 0.84 ADA (0.73) ADA
SCHEMBL6940660 0.83 ADA (0.58) ADASPR
SCHEMBL6933256 0.83 ADA (0.54) ADASPRCYP19A1
SCHEMBL6936327 0.81 ADA (0.51) ADA
SCHEMBL6933250 0.80 ADA (0.71) ADASPR
SCHEMBL6942307 0.79 ADA (0.53) ADA

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
US-6596738-B1 Inhibiting activity to adenosine deaminase (hereinafter described as ADA) An adenosine deaminase inhibiting agent comprising a compound of the formula (I): FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-07-22 US disclosed