SCHEMBL7767482

SCHEMBL7767482

COc1ccc(CSCC2CC(C(C)(C)SCc3ccc(OC)cc3)OC2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.48
MMP1 P03956 2/20 0.37
MMP9 P14780 2/20 0.37
DAO P14920 1/20 0.36
DPP4 P27487 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
GLA P06280 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP13 P45452 1/20 0.33
GRM2 Q14416 1/20 0.33
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
GAA P10253 1/20 0.32
IDO1 P14902 1/20 0.32
ACE P12821 1/20 0.32
MAPT P10636 1/20 0.32
PKM P14618 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
SCHEMBL7767445 0.86 CRBN (0.42) CRBNALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL7765802 0.81 CRBN (0.54) CRBNMMP1MMP9DAOGLA
SCHEMBL7767450 0.72 CRBN (0.41) CRBNALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL7765877 0.72 MMP1 (0.46) CRBNMMP1MMP9ALDH1A1MMP3
SCHEMBL7762208 0.72 MMP1 (0.46) CRBNMMP1MMP9ALDH1A1MMP3
SCHEMBL7764881 0.72 MMP1 (0.46) CRBNMMP1MMP9ALDH1A1MMP3
SCHEMBL23997552 0.68 GLA (0.40) CRBNMMP1MMP9DAOGLA
SCHEMBL6447329 0.68 GLA (0.40) CRBNMMP1MMP9DAOGLA
SCHEMBL7762186 0.66 POLB (0.41) CRBNDAOALDH1A1MMP13GAA
SCHEMBL9196423 0.66 CRBN (0.50) CRBNMMP1MMP9ALDH1A1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0639566-B1 CYCLIC COMPOUND SANTEN PHARMACEUTICAL CO LTD (JP) 2001-06-20 EP disclosed
US-5461158-A Immunodeficiency and autoimmune diseases SANTEN PHARMACEUTICAL CO., LTD. (JP) 1995-10-24 US disclosed
EP-0639566-A1 CYCLIC COMPOUND SANTEN PHARMACEUTICAL CO., LTD. (JP) 1995-02-22 EP disclosed