SCHEMBL6087285

SCHEMBL6087285

CCc1c(C(=O)c2cc(C)cc(C)c2)n(CC2CCC2)c(=O)[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 2/20 0.39
GRIN2B Q13224 2/20 0.39
TPH1 P17752 4/20 0.37
TPH2 Q8IWU9 4/20 0.37
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
ALDH1A1 P00352 3/20 0.35
CYP3A4 P08684 1/20 0.35
HSD17B10 Q99714 2/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
ATM Q13315 1/20 0.34
MTOR P42345 4/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PIK3CA P42336 1/20 0.33

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
SCHEMBL7067487 0.98 GRIN1 (0.39) GRIN1GRIN2BTPH1TPH2MEN1
SCHEMBL6088074 0.97 GRIN1 (0.39) GRIN1GRIN2BTPH1TPH2MEN1
SCHEMBL6087020 0.95 GRIN1 (0.43) GRIN1GRIN2BTPH1TPH2MEN1
SCHEMBL7841353 0.89 GRIN1 (0.34) GRIN1GRIN2BTPH1TPH2MEN1
SCHEMBL675478 0.89 KMT2A (0.35) GRIN1GRIN2BMEN1KMT2ATDP1
SCHEMBL7849809 0.87 GRIN1 (0.38) GRIN1GRIN2BTPH1TPH2MEN1
SCHEMBL7066678 0.87 HPGD (0.40) GRIN1GRIN2BMEN1KMT2ATDP1
SCHEMBL6086536 0.85 KMT2A (0.36) GRIN1GRIN2BMEN1KMT2ATDP1
SCHEMBL6088384 0.84 GRIN1 (0.38) GRIN1GRIN2BTPH1TPH2MEN1
SCHEMBL7848699 0.83 GRIN1 (0.39) GRIN1GRIN2BTPH1TPH2MEN1

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