SCHEMBL4730197

SCHEMBL4730197

CCOC(=O)C(=O)C1c2ccc(Cl)cc2C(=O)OC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 4/20 0.39
MAPT P10636 4/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TP53 P04637 3/20 0.39
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
CYP11B2 P19099 1/20 0.38
GAA P10253 4/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
LMNA P02545 1/20 0.37
KDM4E B2RXH2 1/20 0.36
THRB P10828 1/20 0.36
ALPG P10696 1/20 0.36
MDM2 Q00987 3/20 0.36
KYAT1 Q16773 1/20 0.36
MAOB P27338 1/20 0.36
DPP4 P27487 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL4728259 0.91 CYP11B2 (0.40) MAPK1ALDH1A1MAPTL3MBTL1TP53
SCHEMBL4726123 0.86 TDP2 (0.41) MAPK1ALDH1A1MAPTL3MBTL1TSHR
SCHEMBL4729580 0.84 CYP11B2 (0.51) ALDH1A1MAPTL3MBTL1HTTCYP11B2
SCHEMBL4730195 0.81 ALPG (0.41) MAPK1ALDH1A1MAPTL3MBTL1TP53
SCHEMBL4727318 0.81 ALDH1A1 (0.43) ALDH1A1MAPTL3MBTL1TSHRHTT
SCHEMBL4728256 0.79 ALPG (0.41) MAPK1ALDH1A1MAPTL3MBTL1TP53
SCHEMBL4726625 0.79 CYP11B2 (0.40) ALDH1A1MAPTL3MBTL1CYP11B2GAA
SCHEMBL4726892 0.79 TDP2 (0.46) MAPK1ALDH1A1MAPTL3MBTL1TSHR
SCHEMBL4784489 0.78 CYP1A1 (0.41) ALDH1A1MAPTL3MBTL1TSHRCYP11B2
SCHEMBL4726095 0.73 PPARG (0.46) ALDH1A1L3MBTL1SMN1; SMN2LMNAMAOB

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
WO-2008035356-A2 NOVEL CANNABINOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESS FOR THEIR PREPARATION GLENMARK PHARMACEUTICALS LIMITED (IN) 2008-03-27 WO disclosed