SCHEMBL28680764

SCHEMBL28680764

CCCCCCCCC(CCCC)OC(=O)CCCCC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.62
MAPT P10636 2/20 0.62
FFAR4 Q5NUL3 2/20 0.59
FFAR1 O14842 2/20 0.59
ALDH1A1 P00352 3/20 0.58
LMNA P02545 2/20 0.58
TSHR P16473 5/20 0.57
CYP1A2 P05177 2/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
GMNN O75496 1/20 0.57
HSP90AA1 P07900 1/20 0.57
BLM P54132 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
NR1H4 Q96RI1 1/20 0.57
TP53 P04637 1/20 0.57
CYP2C9 P11712 1/20 0.57
HIF1A Q16665 1/20 0.57
GPR84 Q9NQS5 7/20 0.57
PPARG P37231 6/20 0.57

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
SCHEMBL23860685 1.00 MAPK1 (0.62) MAPK1MAPTFFAR4FFAR1ALDH1A1
SCHEMBL28052462 1.00 MAPK1 (0.62) MAPK1MAPTFFAR4FFAR1ALDH1A1
SCHEMBL30777635 1.00 MAPK1 (0.62) MAPK1MAPTFFAR4FFAR1ALDH1A1
SCHEMBL31294964 1.00 MAPK1 (0.62) MAPK1MAPTFFAR4FFAR1ALDH1A1
SCHEMBL7154095 1.00 MAPK1 (0.62) MAPK1MAPTFFAR4FFAR1ALDH1A1
SCHEMBL23860683 0.98 MAPK1 (0.64) MAPK1MAPTFFAR4FFAR1ALDH1A1
SCHEMBL8656695 0.98 MAPK1 (0.64) MAPK1MAPTFFAR4FFAR1ALDH1A1
SCHEMBL23565739 0.98 MAPK1 (0.64) MAPK1MAPTFFAR4FFAR1ALDH1A1
SCHEMBL22589987 0.98 MAPK1 (0.64) MAPK1MAPTFFAR4FFAR1ALDH1A1
SCHEMBL2154198 0.98 MAPK1 (0.64) MAPK1MAPTFFAR4FFAR1ALDH1A1

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
CN-113671068-A Method for analyzing environmental pollutant targeting exposure component in blood plasma and application thereof 暨南大学 2021-11-19 CN disclosed