SCHEMBL6575964

SCHEMBL6575964

Cc1c(OC(=O)O)cc(OC(=O)O)cc1OC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.40
ELANE P08246 3/20 0.38
MAPT P10636 4/20 0.37
ALDH1A1 P00352 4/20 0.37
GAA P10253 3/20 0.37
HSD17B10 Q99714 3/20 0.37
TSHR P16473 2/20 0.37
GLA P06280 2/20 0.37
CASP1 P29466 2/20 0.37
CASP7 P55210 2/20 0.37
MAPK1 P28482 3/20 0.36
POLB P06746 1/20 0.36
LMNA P02545 4/20 0.35
BACE1 P56817 1/20 0.35
ACHE P22303 1/20 0.35
RAB9A P51151 1/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
CFD P00746 1/20 0.33
TP53 P04637 2/20 0.33

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
SCHEMBL3292047 0.82 KDM4E (0.53) KDM4EELANEMAPTALDH1A1GAA
SCHEMBL7190643 0.79 PKM (0.39) KDM4EELANEMAPTALDH1A1GAA
SCHEMBL5085382 0.79 KDM4E (0.37) KDM4EELANEMAPTALDH1A1GAA
SCHEMBL8030911 0.79 KDM4E (0.37) KDM4EELANEMAPTALDH1A1GAA
SCHEMBL1551913 0.77 KDM4E (0.36) KDM4EELANEMAPTALDH1A1GAA
SCHEMBL322525 0.77 LMNA (0.40) KDM4EELANEMAPTALDH1A1GAA
SCHEMBL7618128 0.77 KDM4E (0.53) KDM4EELANEMAPTGAAMAPK1
SCHEMBL22980920 0.76 TPMT (0.48) ELANEMAPTALDH1A1TSHRMAPK1
SCHEMBL9001070 0.76 LMNA (0.47) KDM4EELANEMAPTALDH1A1TSHR
SCHEMBL984615 0.76 CYP3A4 (0.43) KDM4EMAPTALDH1A1CASP1POLB

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-1161488-B1 THERMOPLASTIC NANOCOMPOSITES BASF AG (DE) 2004-05-06 EP disclosed
EP-1161488-A1 THERMOPLASTIC NANOCOMPOSITES BASF AKTIENGESELLSCHAFT (DE) 2001-12-12 EP disclosed
WO-2000047662-A1 THERMOPLASTIC NANOCOMPOSITES BASF AKTIENGESELLSCHAFT (DE) 2000-08-17 WO disclosed