SCHEMBL1461447

SCHEMBL1461447

CN1C(=O)NC(=O)C1(CO)CO

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
EP300 Q09472 2/20 0.32
CREBBP Q92793 1/20 0.32
HIF1A Q16665 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
SCHEMBL6235409 0.65
SCHEMBL7075012 0.64 LMNA (0.33)
SCHEMBL9775551 0.62 ATAD2 (0.32)
SCHEMBL8157058 0.61 EP300 (0.32) EP300CREBBPHIF1A
SCHEMBL2494243 0.61 KMT2A (0.32) KMT2A
SCHEMBL4621098 0.60
SCHEMBL4778459 0.59
SCHEMBL11027160 0.57 LMNA (0.36)
SCHEMBL376221 0.57 MMP1 (0.33) KMT2A
SCHEMBL8908315 0.55 POLB (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2470008-A2 USE OF CYCLOALIPHATIC DIOLS AS BIOCIDES BASF SE (DE) 2012-07-04 EP disclosed
EP-2470156-A2 USE OF 1,3-DIOLS AS BIOCIDES BASF SE (DE) 2012-07-04 EP disclosed
WO-2011023582-A2 USE OF 1,3-DIOLS AS BIOCIDES BASF SE (DE) 2011-03-03 WO disclosed
WO-2011023540-A2 USE OF CYCLOALIPHATIC DIOLS AS BIOCIDES BASF SE (DE) 2011-03-03 WO disclosed