SCHEMBL6131028

SCHEMBL6131028

CCCCC(CC)C(=O)CC(=O)C(C)(C)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.53
MAPK1 P28482 2/20 0.53
CA1 P00915 5/20 0.49
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SLC1A2 P43004 2/20 0.39
SLC1A1 P43005 2/20 0.39
SLC1A3 P43003 1/20 0.39
USP2 O75604 1/20 0.38
PDF Q9HBH1 1/20 0.35
LMNA P02545 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
GRIK1 P39086 1/20 0.34
GRIK2 Q13002 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
SCHEMBL7710858 0.87 CA2 (0.38) CA2MAPK1CA1MEN1KMT2A
SCHEMBL407163 0.84 CA2 (0.53) CA2MAPK1CA1MEN1ALDH1A1
SCHEMBL27689591 0.82 CA2 (0.52) CA2MAPK1CA1MEN1ALDH1A1
SCHEMBL31042227 0.82 CA2 (0.52) CA2MAPK1CA1MEN1ALDH1A1
SCHEMBL29190445 0.82 CA2 (0.52) CA2MAPK1CA1MEN1ALDH1A1
SCHEMBL29153274 0.81 CA2 (0.64) CA2MAPK1CA1MEN1ALDH1A1
SCHEMBL28953255 0.78 CA2 (0.61) CA2MAPK1CA1MEN1ALDH1A1
SCHEMBL3964956 0.76 CA2 (0.57) CA2MAPK1CA1MEN1ALDH1A1
2-Ethylhexanoic Acid SCHEMBL8157707 0.75 CA2 (0.91) CA2MAPK1CA1MEN1ALDH1A1
SCHEMBL31048063 0.74 CA2 (0.55) CA2MAPK1CA1MEN1ALDH1A1

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-20050253510-A1 Light-emitting device and display device PANASONIC CORPORATION (JP) 2005-11-17 US disclosed