SCHEMBL12288667

SCHEMBL12288667

COc1ccc(NC(=O)Cn2c(=O)n(Cc3ccco3)c(=O)c3sccc32)c(OC)c1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 5/20 0.70
▸ MEN1 O00255 3/20 0.68
▸ KMT2A Q03164 3/20 0.68
▸ MAPT P10636 7/20 0.60
▸ TP53 P04637 5/20 0.60
▸ TDP1 Q9NUW8 3/20 0.55
▸ THRB P10828 3/20 0.54
▸ POLB P06746 3/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51

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
SCHEMBL14707904 0.92 MAPT (0.60) RXFP1MEN1KMT2AMAPTTP53
SCHEMBL12285666 0.86 RXFP1 (0.73) RXFP1MEN1KMT2AMAPTTP53
SCHEMBL12285491 0.83 RXFP1 (1.00) RXFP1MAPTTP53TDP1THRB
SCHEMBL12288668 0.80 RXFP1 (0.82) RXFP1MAPTTP53TDP1THRB
SCHEMBL470775 0.78 MAPT (0.85) RXFP1MEN1KMT2AMAPTTP53
SCHEMBL14707901 0.77 MAPT (0.81) RXFP1MEN1KMT2AMAPTTP53
SCHEMBL12286344 0.73 RXFP1 (0.84) RXFP1MEN1KMT2AMAPTTP53
SCHEMBL12286109 0.72 RXFP1 (0.77) RXFP1MAPTTP53TDP1POLB
SCHEMBL14707905 0.72 RXFP1 (0.71) RXFP1MEN1KMT2AMAPTTP53
SCHEMBL12287169 0.71 RXFP1 (0.80) RXFP1MAPTTP53TDP1POLB

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
US-8927561-B2 Pyrimidinedione anti-viral compounds Kineta, Inc. (US) 2015-01-06 — — US disclosed
WO-2011133722-A2 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2011-10-27 — — WO disclosed
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