SCHEMBL396581

SCHEMBL396581

C=C(CCCNS(=O)(=O)CC)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CA12 O43570 3/20 0.35
CA14 Q9ULX7 3/20 0.35
PTGES O14684 1/20 0.35
CA2 P00918 5/20 0.33
CA1 P00915 4/20 0.33
CA7 P43166 2/20 0.33
FABP4 P15090 2/20 0.33
CA9 Q16790 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
CNR2 P34972 1/20 0.31
TBXAS1 P24557 2/20 0.31
ALOX15 P16050 2/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL10695958 0.84 RELA (0.49) CA12CA14CA2CA1CA7
SCHEMBL397238 0.83 POLB (0.41) KMT2ACA12CA14PTGESFABP4
SCHEMBL18396373 0.81 MEN1 (0.43) MEN1KMT2ACA12CA14PTGES
SCHEMBL18396375 0.81 MEN1 (0.43) MEN1KMT2ACA12CA14PTGES
SCHEMBL10695605 0.77 CA12 (0.39) CA12CA14CA2CA1CA7
SCHEMBL1722670 0.76 MEN1 (0.42) MEN1KMT2ACA12CA14PTGES
SCHEMBL1452765 0.75 EPHX1 (0.47) CA2CA1FABP4LMNA
SCHEMBL303227 0.75 CYP2C19 (0.42) MEN1KMT2ATBXAS1ALOX15HSD17B10
SCHEMBL13840434 0.75 FABP4 (0.56) MEN1KMT2AFABP4ALDH1A1ALOX15
SCHEMBL25737399 0.74 MEN1 (0.38) MEN1KMT2ACA12CA14PTGES

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
US-8101332-B2 Negative-working lithographic printing plate precursor and method of lithographic printing using same FUJIFILM CORPORATION (JP) 2012-01-24 US disclosed
US-20090246688-A1 NEGATIVE-WORKING LITHOGRAPHIC PRINTING PLATE PRECURSOR AND METHOD OF LITHOGRAPHIC PRINTING USING SAME FUJIFILM CORPORATION (JP) 2009-10-01 US disclosed