SCHEMBL11399083

SCHEMBL11399083

CC(=O)NCCCCCCCCCCCCCC(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 1/20 1.00
MAPK1 P28482 2/20 0.73
KDM4E B2RXH2 1/20 0.73
HIF1A Q16665 1/20 0.73
PRMT1 Q99873 1/20 0.68
PAOX Q6QHF9 3/20 0.59
PLA2G2A P14555 1/20 0.56
TSHR P16473 2/20 0.55
LMNA P02545 1/20 0.55
NFKB1 P19838 1/20 0.55
PMP22 Q01453 1/20 0.55
FOLH1 Q04609 1/20 0.53
PLA2G4A P47712 1/20 0.52
EPHX2 P34913 6/20 0.51
ALDH1A1 P00352 1/20 0.50
SLC22A6 Q4U2R8 1/20 0.50
SLC22A8 Q8TCC7 1/20 0.50
GPR84 Q9NQS5 1/20 0.50

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
SCHEMBL4609043 1.00 ADRA1A (1.00) ADRA1AMAPK1KDM4EHIF1APRMT1
SCHEMBL11712278 1.00 ADRA1A (1.00) ADRA1AMAPK1KDM4EHIF1APRMT1
SCHEMBL27099106 1.00 ADRA1A (1.00) ADRA1AMAPK1KDM4EHIF1APRMT1
SCHEMBL7900131 1.00 ADRA1A (1.00) ADRA1AMAPK1KDM4EHIF1APRMT1
SCHEMBL8098661 1.00 ADRA1A (1.00) ADRA1AMAPK1KDM4EHIF1APRMT1
SCHEMBL19816833 1.00 ADRA1A (1.00) ADRA1AMAPK1KDM4EHIF1APRMT1
Acexamic Acid SCHEMBL24435 1.00 ADRA1A (1.00) ADRA1AMAPK1KDM4EHIF1APRMT1
SCHEMBL1001209 1.00 ADRA1A (1.00) ADRA1AMAPK1KDM4EHIF1APRMT1
SCHEMBL22199749 1.00 ADRA1A (1.00) ADRA1AMAPK1KDM4EHIF1APRMT1
Acexamic Acid SCHEMBL1649364 0.98 ADRA1A (0.96) ADRA1AMAPK1KDM4EHIF1APRMT1

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-4264515-A BY REACTING AN OLEFINIC COMPOUND WITH AN AMIDE, CARBON MONOXIDE AND HYDROGEN INSTITUT FRANCAIS DU PETROLE (FR) 1981-04-28 US disclosed