SCHEMBL6088271

SCHEMBL6088271

CCc1c(Oc2cc(C)cc(C)c2)n(Cc2c3ccccc3cc3ccccc23)c(=O)[nH]c1=O

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPBWR1 P48145 1/20 0.35
KDM4E B2RXH2 4/20 0.34
GAA P10253 2/20 0.34
HPGD P15428 3/20 0.33
HTT P42858 3/20 0.33
MEN1 O00255 2/20 0.33
TSHR P16473 2/20 0.33
KMT2A Q03164 2/20 0.33
MAPK1 P28482 1/20 0.33
PSMD14 O00487 1/20 0.33
DRD1 P21728 2/20 0.32
ALDH1A1 P00352 2/20 0.32
PDE10A Q9Y233 1/20 0.32
MAPT P10636 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.32
POLB P06746 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL6086864 0.85 HPGD (0.44) KDM4EGAAHPGDHTTMEN1
SCHEMBL6088257 0.85 NPBWR1 (0.34) NPBWR1KDM4EGAAHPGDHTT
SCHEMBL6087014 0.85 DAO (0.46) KDM4EGAAHPGDHTTMEN1
SCHEMBL6087044 0.82 SMN1; SMN2 (0.37) KDM4EGAAHPGDHTTMEN1
SCHEMBL6086356 0.82 PDE10A (0.42) KDM4EDRD1ALDH1A1PDE10ACYP1A2
SCHEMBL6088051 0.80 GRIN1 (0.45) DRD1
SCHEMBL7850946 0.79 NPBWR1 (0.31) NPBWR1KDM4EALDH1A1
SCHEMBL6088668 0.79 POLB (0.35) KDM4EGAAHTTMEN1TSHR
SCHEMBL6086483 0.79 MTNR1A (0.50) MEN1TSHRKMT2AALDH1A1POLB
SCHEMBL6086995 0.79 POLB (0.35) KDM4EGAAHPGDHTTMEN1

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