SCHEMBL6424862

SCHEMBL6424862

CCOc1cc(C(CO)c2c(Cl)cncc2Cl)ccc1OC

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.42
S1PR3 Q99500 1/20 0.42
PDE4D Q08499 6/20 0.41
PDE4A P27815 4/20 0.41
PDE4B Q07343 4/20 0.41
PDE4C Q08493 4/20 0.41
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
PPARA Q07869 1/20 0.41
TSHR P16473 1/20 0.40
ALDH1A1 P00352 3/20 0.40
KCNH2 Q12809 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
CYP2B6 P20813 1/20 0.38
FYN P06241 1/20 0.38
FPR2 P25090 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL14164953 0.91 PPARG (0.49) PDE4DPDE4APPARGPPARDPPARA
SCHEMBL14164834 0.91 PPARG (0.49) PDE4DPDE4APPARGPPARDPPARA
SCHEMBL8890131 0.81 PDE4A (0.43) PDE4DPDE4APDE4BPDE4CALDH1A1
SCHEMBL3550785 0.78 PDE4D (0.48) S1PR1S1PR3PDE4DPDE4APDE4B
SCHEMBL3662407 0.77 TDP2 (0.42) ALDH1A1SMN1; SMN2LMNA
SCHEMBL15790499 0.74 PDE4D (0.45) S1PR1S1PR3PDE4DPDE4APDE4B
SCHEMBL16671314 0.72 PDE4A (0.61) PDE4DPDE4APDE4BPDE4C
SCHEMBL16956835 0.72 PPARG (0.50) PDE4DPDE4APDE4BPDE4CPPARG
SCHEMBL4818551 0.71 PPARG (0.51) PDE4DPDE4APDE4BPDE4CPPARG
SCHEMBL15776890 0.71 PDE4D (0.47) PDE4DPDE4APDE4BPDE4CPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1605896-A2 7-AMINO- ISOINDOLYL COMPOUNDS AMD THEIR PHARMACEUTICAL USES CELGENE CORPORATION (US) 2005-12-21 EP disclosed
WO-2004080423-A2 7-AMINO- ISOINDOLYL COMPOUNDS AMD THEIR PHARMACEUTICAL USES CELGENE CORPORATION (US) 2004-09-23 WO disclosed