SCHEMBL6933243

SCHEMBL6933243

CC(C)(C)[Si](C)(C)O[C@H](CCCn1ccc2ccc(N)cc21)n1cnc(C(N)=O)c1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADA P00813 19/20 0.53
MCL1 Q07820 1/20 0.36

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
SCHEMBL6942307 0.92 ADA (0.53) ADAMCL1
SCHEMBL6933487 0.89 ADA (0.49) ADA
SCHEMBL6938456 0.89 ADA (0.70) ADAMCL1
SCHEMBL6940591 0.88 ADA (0.68) ADAMCL1
SCHEMBL6933498 0.88 ADA (0.50) ADA
SCHEMBL6936324 0.86 ADA (0.71) ADAMCL1
SCHEMBL6936327 0.86 ADA (0.51) ADA
SCHEMBL6942770 0.86 ADA (0.60) ADAMCL1
SCHEMBL6933245 0.86 ADA (0.38) ADA
SCHEMBL6941943 0.85 ADA (0.71) ADAMCL1

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