SCHEMBL2918368

SCHEMBL2918368

CC(=O)CC/C=C(\C)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.45
ATM Q13315 1/20 0.45
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.42
SLC15A2 Q16348 1/20 0.42
PPARG P37231 1/20 0.41
CD81 P60033 2/20 0.40
BACE1 P56817 2/20 0.40
POLB P06746 1/20 0.39
FNTA P49354 2/20 0.35
FNTB P49356 2/20 0.35
KDM1A O60341 1/20 0.35
TRPA1 O75762 2/20 0.35
TBXAS1 P24557 1/20 0.34
ALOX5 P09917 1/20 0.33
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL2918372 1.00 KDM4E (0.45) KDM4EATMALDH1A1LMNASLC15A2
SCHEMBL10571831 0.91 PPARG (0.51) KDM4EATMALDH1A1PPARGBACE1
SCHEMBL5369541 0.91 PPARG (0.51) KDM4EATMALDH1A1PPARGBACE1
SCHEMBL10574231 0.91 PPARG (0.51) KDM4EATMALDH1A1PPARGBACE1
SCHEMBL10574296 0.91 PPARG (0.51) KDM4EATMALDH1A1PPARGBACE1
SCHEMBL10571838 0.91 PPARG (0.51) KDM4EATMALDH1A1PPARGBACE1
SCHEMBL10577114 0.91 PPARG (0.51) KDM4EATMALDH1A1PPARGBACE1
SCHEMBL10574272 0.91 PPARG (0.51) KDM4EATMALDH1A1PPARGBACE1
SCHEMBL27626845 0.91 PPARG (0.51) KDM4EATMALDH1A1PPARGBACE1
SCHEMBL5369537 0.91 PPARG (0.51) KDM4EATMALDH1A1PPARGBACE1

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-2152400-B1 METAL SALT NANOGEL-CONTAINING POLYMERS HELLING INNOVATION UG HAFTUNGS (DE) 2010-08-25 EP disclosed
EP-2152400-A1 METAL SALT NANOGEL-CONTAINING POLYMERS Helling Innovation UG (haftungsbeschränkt) (DE) 2010-02-17 EP disclosed
WO-2008135212-A1 METAL SALT NANOGEL-CONTAINING POLYMERS HELLING GUENTER (DE) 2008-11-13 WO disclosed