SCHEMBL6087754

SCHEMBL6087754

CCc1c(C(=O)c2cc(C)cc(C)c2)n(CC(C)=O)c(=O)[nH]c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
GRIN1 Q05586 2/20 0.33
GRIN2B Q13224 2/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
RECQL P46063 1/20 0.32
TP53 P04637 1/20 0.32
TPMT P51580 1/20 0.31
ADCY8 P40145 1/20 0.31
ADCY1 Q08828 1/20 0.31
PDE3B Q13370 1/20 0.31
PDE3A Q14432 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
SCHEMBL12752168 0.89 KMT2A (0.40) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL6089500 0.86 TPH1 (0.38) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL7758274 0.85 TPH1 (0.37) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL7753931 0.84 KMT2A (0.37) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL7758821 0.84 KMT2A (0.37) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL7031964 0.84 KMT2A (0.39) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL6087554 0.84 ALDH1A1 (0.40) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL6088185 0.84 KMT2A (0.37) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL7757663 0.83 KMT2A (0.36) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL6087020 0.83 GRIN1 (0.43) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1

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-6987114-B1 Antiviral pyrimidinedione derivatives and process for the preparation thereof SAMJIN PHARMACEUTICAL CO., LTD (KR) 2006-01-17 US disclosed