SCHEMBL586931

SCHEMBL586931

CCOC(=O)CC(=O)C1CCN(C)C(c2cc(F)c(Cl)c(F)c2)C1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
TSHR P16473 3/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 5/20 0.36
MEN1 O00255 1/20 0.36
TDP1 Q9NUW8 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPT P10636 1/20 0.35
WDR5 P61964 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL581133 0.87 KDM4E (0.37) KDM4ESMN1; SMN2TSHRPOLBKMT2A
SCHEMBL581760 0.87 KDM4E (0.37) KDM4ESMN1; SMN2TSHRPOLBKMT2A
SCHEMBL3063338 0.87 KDM4E (0.37) KDM4ESMN1; SMN2TSHRPOLBKMT2A
SCHEMBL582160 0.84 KMT2A (0.41) KDM4EPOLBKMT2AALDH1A1MEN1
SCHEMBL600157 0.83 KDM4E (0.35) KDM4ESMN1; SMN2TSHRPOLBKMT2A
SCHEMBL581788 0.82 HSD17B10 (0.40) KDM4ESMN1; SMN2TSHRPOLBKMT2A
SCHEMBL3078762 0.78 ALDH1A1 (0.35) KDM4ESMN1; SMN2TSHRPOLBKMT2A
SCHEMBL581047 0.78 ALDH1A1 (0.35) KDM4ESMN1; SMN2TSHRPOLBKMT2A
SCHEMBL3074921 0.78 ALDH1A1 (0.35) KDM4ESMN1; SMN2TSHRPOLBKMT2A
SCHEMBL3069685 0.76 SMN1; SMN2 (0.38) KDM4ESMN1; SMN2TSHRPOLBKMT2A

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-2417131-A1 ISOXAZOL-3(2H)-ONE ANALOGS AS THERAPEUTIC AGENTS AstraZeneca AB (SE) 2012-02-15 EP disclosed
WO-2010117323-A1 METHOD AND APPARATUS FOR PRODUCING HEAT ENERGY AND CARBON DIOXIDE ASTRAZENECA AB (SE) 2010-10-14 WO disclosed