SCHEMBL16450910

SCHEMBL16450910

CCCCOC(=O)C(CC)CC(C)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.44
ATM Q13315 1/20 0.44
MAPK1 P28482 1/20 0.44
HCAR2 Q8TDS4 3/20 0.43
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
CA1 P00915 2/20 0.41
ACE2 Q9BYF1 1/20 0.40
SLC1A3 P43003 2/20 0.35
SLC1A2 P43004 2/20 0.35
SLC1A1 P43005 2/20 0.35
NAAA Q02083 1/20 0.35

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
SCHEMBL17753384 0.97 CA2 (0.46) CA2ATMMAPK1HCAR2ALDH1A1
SCHEMBL19498780 0.88 ATM (0.46) CA2ATMMAPK1HCAR2ALDH1A1
SCHEMBL4848334 0.87 ALDH1A1 (0.54) CA2ATMMAPK1HCAR2ALDH1A1
SCHEMBL17878550 0.84 ALDH1A1 (0.47) CA2ATMMAPK1HCAR2ALDH1A1
SCHEMBL14459842 0.84 ALDH1A1 (0.47) CA2ATMMAPK1HCAR2ALDH1A1
SCHEMBL20328994 0.82 CA2 (0.41) CA2ATMMAPK1HCAR2ALDH1A1
SCHEMBL12173369 0.82 MEN1 (0.40) CA2MAPK1ALDH1A1SLC1A3SLC1A2
SCHEMBL1759482 0.81 ALDH1A1 (0.56) CA2ATMMAPK1HCAR2ALDH1A1
SCHEMBL17688841 0.80 CHRM1 (0.43) MAPK1TSHR
SCHEMBL17717746 0.80 CA2 (0.39) CA2ATMMAPK1HCAR2ALDH1A1

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-20150041042-A1 PRESSURE SENSITIVE ADHESIVE TYPE OF WAVELENGTH CONVERSION TAPE FOR ENHANCING SOLAR HARVESTING EFFICIENCY NITTO DENKO CORPORATION (JP) 2015-02-12 US disclosed