SCHEMBL12286344

SCHEMBL12286344

COc1ccccc1NC(=O)Cn1c(=O)n(Cc2ccco2)c(=O)c2sc3ccccc3c21

nearest known ligand 0.85

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 6/20 0.84
▸ TDP1 Q9NUW8 1/20 0.78
▸ TP53 P04637 9/20 0.78
▸ MAPT P10636 8/20 0.78
▸ POLB P06746 3/20 0.78
▸ THRB P10828 1/20 0.68
▸ MEN1 O00255 1/20 0.61
▸ KMT2A Q03164 1/20 0.61

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
SCHEMBL12285491 0.91 RXFP1 (1.00) RXFP1TDP1TP53MAPTPOLB
SCHEMBL12286377 0.89 TP53 (0.73) RXFP1TDP1TP53MAPTPOLB
SCHEMBL14707921 0.89 TP53 (0.84) RXFP1TDP1TP53MAPTPOLB
SCHEMBL12286213 0.88 POLB (0.79) RXFP1TDP1TP53MAPTPOLB
SCHEMBL12286280 0.88 POLB (0.79) RXFP1TDP1TP53MAPTPOLB
SCHEMBL12285854 0.88 TP53 (0.84) RXFP1TDP1TP53MAPTPOLB
SCHEMBL12285852 0.87 TP53 (0.86) RXFP1TDP1TP53MAPTPOLB
SCHEMBL12286278 0.87 RXFP1 (0.86) RXFP1TDP1TP53MAPTPOLB
SCHEMBL14707928 0.87 TP53 (0.74) RXFP1TDP1TP53MAPTPOLB
SCHEMBL14707922 0.86 TP53 (0.73) RXFP1TDP1TP53MAPTPOLB

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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