SCHEMBL13921995

SCHEMBL13921995

C=C(C)COOc1ccc(NC(=O)C(C)CC)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA7 P43166 1/20 0.49
CA14 Q9ULX7 1/20 0.49
GPR174 Q9BXC1 1/20 0.45
KMT2A Q03164 4/20 0.44
HSD17B10 Q99714 3/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.42
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
MME P08473 1/20 0.41
ACE P12821 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 2/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL11913581 0.78 CA1 (0.51) CA1CA2CA7CA14KMT2A
SCHEMBL12125178 0.77 KMT2A (0.69) CA1CA2CA7CA14KMT2A
SCHEMBL1104128 0.76 GPR174 (0.45) GPR174KMT2AHSD17B10ALDH1A1MAPT
SCHEMBL12329947 0.73 NPY5R (0.64) CA1CA2CA7CA14ALDH1A1
SCHEMBL18594457 0.72 CA1 (0.54) CA1CA2CA7CA14KMT2A
SCHEMBL18896221 0.72 EPHX2 (0.59) CA1CA2CA7CA14KMT2A
SCHEMBL13761374 0.72 CA1 (0.60) CA1CA2CA7CA14KMT2A
SCHEMBL12125174 0.72 CA1 (0.64) CA1CA2CA7CA14HSD17B10
SCHEMBL97700 0.72 CA1 (0.64) CA1CA2CA7CA14KMT2A
SCHEMBL12677519 0.71 CA1 (0.63) CA1CA2CA7CA14KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7507525-B2 Polymerizable composition and lithographic printing plate precursor FUJIFILM CORPORATION (JP) 2009-03-24 US disclosed