SCHEMBL28757779

SCHEMBL28757779

CCOC(=O)/C(Cc1ccccc1)=C(/Cc1ccccc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 4/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.44
MAPK1 P28482 1/20 0.44
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
AKR1B1 P15121 1/20 0.44
NR1H4 Q96RI1 1/20 0.43
PAM P19021 1/20 0.43
TSHR P16473 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 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
SCHEMBL305362 0.87 MEN1 (0.46) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
Ammonia Solution, Strong SCHEMBL28749788 0.85 MEN1 (0.47) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL11446355 0.83 MEN1 (0.46) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL9003251 0.83 MEN1 (0.46) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL11446353 0.83 MEN1 (0.46) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL9003247 0.83 MEN1 (0.46) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL3881031 0.81 CES1 (0.64) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL384895 0.81 CES1 (0.64) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL384894 0.81 CES1 (0.64) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL1119176 0.80 CES2 (0.59) MEN1KMT2AALDH1A1MAPTSMN1; SMN2

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
CN-100415778-C Components and catalysts for the polymerization of olefins BASELL POLIOLEFINE S P A (IT) 2008-09-03 CN disclosed
CN-1714105-A Components and catalysts for the polymerization of olefins BASELL POLIOLEFINE S P A (IT) 2005-12-28 CN disclosed