SCHEMBL6087771

SCHEMBL6087771

CCc1c(Oc2cc(C)cc(C)c2)n(Cc2ccccc2C#N)c(=O)[nH]c1=O

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 13/20 0.50
GRIN2B Q13224 13/20 0.50
AGTR1 P30556 1/20 0.40
DPP4 P27487 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
NOX4 Q9NPH5 1/20 0.37

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
SCHEMBL6086571 0.85 GRIN1 (0.49) GRIN1GRIN2BAGTR1DPP4RXFP1
SCHEMBL7848747 0.84 GRIN1 (0.50) GRIN1GRIN2BDPP4RXFP1NOX4
SCHEMBL6086864 0.83 HPGD (0.44)
SCHEMBL6087695 0.82 GRIN1 (0.44) GRIN1GRIN2BDPP4
SCHEMBL6086089 0.80 GRIN1 (0.50) GRIN1GRIN2BAGTR1DPP4NOX4
SCHEMBL6086254 0.80 GRIN1 (0.50) GRIN1GRIN2BAGTR1DPP4
SCHEMBL6087044 0.79 SMN1; SMN2 (0.37)
SCHEMBL6087014 0.78 DAO (0.46)
SCHEMBL6088271 0.78 NPBWR1 (0.35)
SCHEMBL6088051 0.78 GRIN1 (0.45) GRIN1GRIN2BNOX4

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