SCHEMBL10798066

SCHEMBL10798066

CCOc1c(OCCO)ccc(C(C)=O)c1OCC.O=C(c1ccccc1)c1ccc(OCCO)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.60
▸ L3MBTL1 Q9Y468 5/20 0.52
▸ LMNA P02545 4/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ MAPT P10636 5/20 0.50
▸ HCRTR1 O43613 1/20 0.46
▸ HCRTR2 O43614 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ CASP6 P55212 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ HTT P42858 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ GRM2 Q14416 1/20 0.44
▸ PPARA Q07869 3/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ CYP19A1 P11511 1/20 0.42

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
SCHEMBL9808707 0.84 LMNA (0.44) GAAL3MBTL1LMNAMAPTALDH1A1
SCHEMBL887049 0.78 GAA (1.00) GAAL3MBTL1LMNAMAPK1MAPT
SCHEMBL29985877 0.76 LMNA (0.54) L3MBTL1LMNAMAPK1MAPTPOLB
SCHEMBL11695549 0.76 LMNA (0.54) L3MBTL1LMNAMAPK1MAPTPOLB
SCHEMBL10498173 0.75 TSHR (0.55) L3MBTL1LMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL31108801 0.74 GAA (0.61) GAAL3MBTL1LMNAMAPK1MAPT
Methacrylic Acid SCHEMBL29173686 0.74 GAA (0.79) GAAL3MBTL1LMNAMAPK1MAPT
SCHEMBL845256 0.73 L3MBTL1 (0.77) GAAL3MBTL1LMNAMAPK1MAPT
SCHEMBL5163358 0.73 CNR1 (0.50) L3MBTL1LMNAMAPK1MAPTPOLB
SCHEMBL28758225 0.72 LMNA (0.49) L3MBTL1LMNAMAPK1MAPTPOLB

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-0216884-A1 PHOTO-INITIATOR FOR THE PHOTO-POLYMERIZATION OF UNSATURATED SYSTEMS. MERCK PATENT GMBH (DE) 1987-04-08 — — EP disclosed
WO-1986005778-A1 PHOTO-INITIATORS FOR PHOTO-POLYMERIZATION OF UNSATURATED SYSTEMS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1986-10-09 — — WO disclosed
WO-1986005777-A1 PHOTO-INITIATOR FOR THE PHOTO-POLYMERIZATION OF UNSATURATED SYSTEMS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1986-10-09 — — WO disclosed
Send feedback