SCHEMBL13869872

SCHEMBL13869872

CCOC(=O)c1c(NC(C)=O)sc2c1CCCC2Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 1/20 0.54
CNR2 P34972 1/20 0.52
ALDH1A1 P00352 8/20 0.50
TLR2 O60603 5/20 0.50
MAPT P10636 5/20 0.50
HPGD P15428 4/20 0.50
NPSR1 Q6W5P4 4/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TSHR P16473 1/20 0.48
USP2 O75604 2/20 0.48
MAPK1 P28482 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
HTT P42858 1/20 0.48
GAA P10253 2/20 0.48
KDM4E B2RXH2 2/20 0.48
HSD17B10 Q99714 2/20 0.48
LMNA P02545 1/20 0.48
ALOX12 P18054 1/20 0.48
TP53 P04637 1/20 0.48

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
SCHEMBL13886691 0.84 CXCR2 (0.61) PDE4DCNR2ALDH1A1TLR2HPGD
SCHEMBL3986607 0.82 MAPT (0.57) PDE4DCNR2ALDH1A1TLR2MAPT
SCHEMBL13869873 0.82 ALDH1A1 (0.52) CNR2ALDH1A1MAPTHPGDNPSR1
SCHEMBL3990554 0.78 PDE4D (0.56) PDE4DCNR2ALDH1A1TLR2MAPT
SCHEMBL3984680 0.78 MAPT (0.59) PDE4DCNR2TLR2MAPTHPGD
SCHEMBL13886693 0.78 ALDH1A1 (0.49) PDE4DCNR2ALDH1A1TLR2MAPT
SCHEMBL3981360 0.76 ALDH1A1 (0.52) PDE4DCNR2ALDH1A1TLR2MAPT
SCHEMBL13886694 0.72 ALDH1A1 (0.48) PDE4DCNR2ALDH1A1MAPTHPGD
SCHEMBL3987266 0.72 MAPT (0.48) PDE4DCNR2ALDH1A1TLR2MAPT
SCHEMBL6033998 0.71 MAPT (0.52) PDE4DCNR2ALDH1A1MAPTHPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 US disclosed
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 US disclosed