SCHEMBL6086801

SCHEMBL6086801

CCc1c(Oc2cc(C)cc(C)c2)n(Cc2occc2C(=O)OC)c(=O)[nH]c1=O

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 2/20 0.35
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
THRB P10828 1/20 0.33
GSK3B P49841 1/20 0.33
GAA P10253 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 3/20 0.32
HSD17B10 Q99714 1/20 0.32
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
KDM4E B2RXH2 2/20 0.31
POLB P06746 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
SCHEMBL7851704 0.93 GSK3B (0.32) DRD1MAPTSMN1; SMN2THRBGSK3B
SCHEMBL6086522 0.86 SMN1; SMN2 (0.33) MAPTSMN1; SMN2THRBGSK3BGAA
SCHEMBL6086953 0.84 KMT2A (0.35) DRD1MAPTSMN1; SMN2THRBGSK3B
SCHEMBL7852882 0.81 GSK3B (0.31) GSK3B
SCHEMBL7849860 0.78 DHODH (0.33) MAPTSMN1; SMN2THRBGSK3BKMT2A
SCHEMBL6087044 0.76 SMN1; SMN2 (0.37) DRD1MAPTSMN1; SMN2THRBGAA
SCHEMBL6086864 0.76 HPGD (0.44) MAPTGAANPSR1ALDH1A1HSD17B10
SCHEMBL6087042 0.75 SMN1; SMN2 (0.36) DRD1MAPTSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL6085479 0.74 MTNR1A (0.37) MAPTSMN1; SMN2GAANPSR1ALDH1A1
SCHEMBL6086483 0.73 MTNR1A (0.50) ALDH1A1HSD17B10KMT2AMEN1POLB

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