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SCHEMBL14965264

SCHEMBL14965264

CC(C)NC(=O)c1sc2ncnc(N3C4CCC3CC(COCCN)C4)c2c1-c1ccccc1.CC(C)NC(=O)c1sc2ncnc(N3C4CCC3CC(COCCOS(C)(=O)=O)C4)c2c1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CDK8 P49336 1/20 0.31

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
SCHEMBL16293392 0.96 TP53 (0.35) TP53RXFP1MEN1MAPTHTT
SCHEMBL16294087 0.94 TP53 (0.37) TP53RXFP1
SCHEMBL14965198 0.94 TP53 (0.37) TP53RXFP1
SCHEMBL14965183 0.87 MKNK2 (0.35) TP53RXFP1
SCHEMBL14965159 0.87 TP53 (0.37) TP53RXFP1
SCHEMBL14964969 0.85 — —
SCHEMBL16293239 0.78 — —
SCHEMBL14965464 0.78 TP53 (0.41) TP53RXFP1MEN1MAPTKMT2A
SCHEMBL14965197 0.76 GPR55 (0.38) —
SCHEMBL14965298 0.71 MEN1 (0.39) MEN1MAPTKMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2780343-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS Xention Limited (GB) 2014-09-24 — — EP disclosed
WO-2013072694-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS XENTION LIMITED (GB) 2013-05-23 — — WO disclosed