SCHEMBL8209099

SCHEMBL8209099

CCN(CCNC)C(=O)N1CCSc2ccc(OC)cc2C1

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RYR2 Q92736 20/20 0.81

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
SCHEMBL806682 0.90 RYR2 (1.00) RYR2
SCHEMBL6866480 0.81 RYR2 (1.00) RYR2
SCHEMBL12265307 0.79 RYR2 (0.88) RYR2
SCHEMBL6867184 0.78 RYR2 (0.84) RYR2
SCHEMBL6867569 0.78 RYR2 (0.82) RYR2
SCHEMBL3428542 0.77 RYR2 (0.77) RYR2
SCHEMBL806609 0.76 RYR2 (1.00) RYR2
SCHEMBL6867475 0.76 RYR2 (0.86) RYR2
SCHEMBL807117 0.76 RYR2 (0.79) RYR2
SCHEMBL3428995 0.76 RYR2 (0.83) RYR2

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
WO-2008021439-A2 COMPOSITIONS AND METHODS FOR TREATMENT OF CARDIAC HYPERTROPHY THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2008-02-21 WO disclosed