SCHEMBL3665524

SCHEMBL3665524

CCC(F)CCC(CC(=O)O)n1cc(O)c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.39
ALDH1A1 P00352 6/20 0.39
HSD17B10 Q99714 2/20 0.39
MAPT P10636 2/20 0.35
RECQL P46063 1/20 0.35
KMT2A Q03164 2/20 0.34
USP2 O75604 1/20 0.34
POLB P06746 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.33
MCL1 Q07820 1/20 0.33
MEN1 O00255 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 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
SCHEMBL16862687 0.88 CDC25A (0.41) KDM4EALDH1A1HSD17B10
SCHEMBL16862685 0.88 CDC25A (0.41) KDM4EALDH1A1HSD17B10
SCHEMBL3666197 0.87 KDM4E (0.38) KDM4EALDH1A1HSD17B10MAPTRECQL
SCHEMBL285391 0.87 KDM4E (0.41) KDM4EALDH1A1HSD17B10MAPTRECQL
SCHEMBL3665611 0.84 ALDH1A1 (0.40) KDM4EALDH1A1HSD17B10MAPTRECQL
SCHEMBL4212531 0.84 ALDH1A1 (0.43) KDM4EALDH1A1HSD17B10
SCHEMBL284847 0.83 ALDH1A1 (0.42) KDM4EALDH1A1HSD17B10MAPTRECQL
SCHEMBL16862611 0.83 CDC25A (0.44) KDM4EALDH1A1HSD17B10
SCHEMBL16862682 0.83 CDC25A (0.44) KDM4EALDH1A1HSD17B10
SCHEMBL285220 0.81 ALDH1A1 (0.41) KDM4EALDH1A1HSD17B10USP2POLB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2235202-B1 METHOD FOR DETECTING AND/OR IDENTIFYING CLOSTRIDIUM DIFFICILE BIOMERIEUX SA (FR) 2013-06-19 EP disclosed
US-8404460-B2 Method for detecting and/or identifying Clostridium difficile BIOMERIEUX (FR) 2013-03-26 US disclosed
US-20100279330-A1 METHOD FOR DETECTING AND/OR IDENTIFYING CLOSTRIDIUM DIFFICILE BIOMERIEUX (FR) 2010-11-04 US disclosed
EP-2235202-A2 METHOD FOR DETECTING AND/OR IDENTIFYING CLOSTRIDIUM DIFFICILE Biomérieux (FR) 2010-10-06 EP disclosed
WO-2009092982-A2 METHOD FOR DETECTING AND/OR IDENTIFYING CLOSTRIDIUM DIFFICILE bioMérieux (FR) 2009-07-30 WO disclosed