SCHEMBL6937608

SCHEMBL6937608

C[C@H](O)[C@@H](CCn1ccc2ccc(Cl)cc21)n1cnc(C(N)=O)c1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADA P00813 17/20 0.55

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
SCHEMBL6940398 0.89 ADA (0.56) ADA
SCHEMBL6938258 0.86 ADA (0.61) ADA
SCHEMBL6941802 0.86 ADA (0.78) ADA
SCHEMBL6939004 0.84 ADA (0.54) ADA
SCHEMBL6939010 0.84 ADA (0.77) ADA
SCHEMBL6936372 0.78 ADA (0.75) ADA
SCHEMBL5673451 0.77 ADA (0.82) ADA
SCHEMBL6937612 0.77 ADA (0.49) ADA
SCHEMBL6133741 0.76 ADA (0.79) ADA
SCHEMBL6133842 0.76 ADA (0.67) 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