SCHEMBL20169630

SCHEMBL20169630

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.39
MAPK1 P28482 1/20 0.39
HSPD1 P10809 1/20 0.37
BLM P54132 1/20 0.37
HSPE1 P61604 1/20 0.37
GPR84 Q9NQS5 3/20 0.34
FFAR1 O14842 1/20 0.34
SLC1A2 P43004 2/20 0.34
SLC1A1 P43005 2/20 0.34
SLC1A3 P43003 1/20 0.34
GRIK1 P39086 2/20 0.33
GRIK2 Q13002 2/20 0.33
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LCK P06239 1/20 0.33
PPARD Q03181 1/20 0.33

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
SCHEMBL16382108 0.88 CHRM1 (0.33) CA2MAPK1HSPD1BLMHSPE1
SCHEMBL20689733 0.85 CA2 (0.37) CA2MAPK1HSPD1BLMHSPE1
SCHEMBL31109151 0.84 HSPD1 (0.41) CA2MAPK1HSPD1BLMHSPE1
SCHEMBL24401338 0.81 GPR84 (0.40) CA2MAPK1HSPD1BLMHSPE1
SCHEMBL16281726 0.79 CA2 (0.31) CA2MAPK1HSPD1BLMHSPE1
SCHEMBL13359873 0.79 CA2 (0.31) CA2MAPK1HSPD1BLMHSPE1
SCHEMBL29149143 0.79 CA2 (0.38) CA2MAPK1HSPD1BLMHSPE1
SCHEMBL21902155 0.77 CA2 (0.44) CA2MAPK1HSPD1BLMHSPE1
SCHEMBL28774032 0.77 CA2 (0.44) CA2MAPK1HSPD1BLMHSPE1
SCHEMBL8847230 0.77 CA2 (0.36) CA2MAPK1HSPD1BLMHSPE1

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-9974732-B2 Cleansing composition KAO CORPORATION (JP) 2018-05-22 US disclosed