SCHEMBL9507602

SCHEMBL9507602

CCCCOC(O)C(COc1ccccc1C(C)(C)c1ccccc1OCC(CC1CO1)C(O)OCCCC)CC1CO1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAPT P10636 4/20 0.34
MEN1 O00255 5/20 0.33
KMT2A Q03164 5/20 0.33
GLA P06280 1/20 0.32
TP53 P04637 3/20 0.32
HPGD P15428 2/20 0.31
TSHR P16473 2/20 0.31
CYP1A2 P05177 2/20 0.31
PPARG P37231 1/20 0.31
HIF1A Q16665 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
ALOX15 P16050 2/20 0.30

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
SCHEMBL9507732 0.77 MEN1 (0.42) ALDH1A1SMN1; SMN2L3MBTL1MAPTMEN1
SCHEMBL2905738 0.69 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL8439639 0.66 MAPT (0.46) ALDH1A1SMN1; SMN2L3MBTL1MAPTMEN1
SCHEMBL3391824 0.66 LMNA (0.52) ALDH1A1SMN1; SMN2L3MBTL1MAPTMEN1
SCHEMBL11090576 0.65 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL11496838 0.65 MAPT (0.54) ALDH1A1SMN1; SMN2L3MBTL1MAPTKMT2A
SCHEMBL868710 0.63 CYP1A2 (0.63) ALDH1A1SMN1; SMN2L3MBTL1MAPTMEN1
SCHEMBL7282087 0.63 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL29690536 0.63 CYP1A2 (0.63) ALDH1A1SMN1; SMN2L3MBTL1MAPTMEN1
SCHEMBL9579880 0.63 CYP1A2 (0.53) ALDH1A1L3MBTL1MAPTMEN1KMT2A

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-0305325-B1 CO-ADVANCED EPOXY RESINS FROM POLYGLYCIDYL ETHERS OF POLYHYDRIC PHENOLS AND DIGLYCIDYL ETHERS OF DI-SECONDARY ALCOHOLS CIBA-GEIGY AG (CH) 1993-09-08 EP disclosed
EP-0305325-A2 Co-advanced epoxy resins from polyglycidyl ethers of polyhydric phenols and diglycidyl ethers of di-secondary alcohols CIBA-GEIGY AG (CH) 1989-03-01 EP disclosed