SCHEMBL21089636

SCHEMBL21089636

CCCCNNC(=O)CCCCCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.57
PPARG P37231 7/20 0.57
PPARD Q03181 7/20 0.57
PPARA Q07869 7/20 0.57
HDAC11 Q96DB2 5/20 0.57
TSHR P16473 4/20 0.57
PTPN1 P18031 3/20 0.57
ALDH1A1 P00352 2/20 0.57
TLR2 O60603 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
FABP4 P15090 2/20 0.57
KMT2A Q03164 2/20 0.57
SLC22A6 Q4U2R8 1/20 0.57
SLC22A8 Q8TCC7 1/20 0.57
MEN1 O00255 1/20 0.57
ESR1 P03372 1/20 0.57
ALOX15 P16050 1/20 0.57
PDE4A P27815 1/20 0.57
PDE3A Q14432 1/20 0.57
HSD17B10 Q99714 1/20 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
SCHEMBL6641767 0.90 HSP90AA1 (0.57) KMT2AMEN1HDAC3HDAC1HDAC2
SCHEMBL7400546 0.87 AKR1B1 (0.56) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL6636306 0.86 HSP90AA1 (0.57) KMT2AMEN1HDAC3HDAC1HDAC2
SCHEMBL3357547 0.86 HSP90AA1 (0.57) KMT2AMEN1HDAC3HDAC1HDAC2
SCHEMBL6635259 0.86 HDAC3 (0.59) HDAC11ALDH1A1KMT2AMEN1HDAC3
SCHEMBL30743896 0.85 GPR84 (0.52) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL6636541 0.82 CASP2 (0.53) KMT2AMEN1HDAC3HDAC1HDAC2
SCHEMBL249559 0.82 HDAC3 (0.61) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL4662735 0.82 HDAC3 (0.61) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL2416986 0.82 HDAC3 (0.61) GPR84PPARGPPARDPPARAHDAC11

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
EP-3226906-B1 GLP-1 DERIVATIVES AND USES THEREOF NOVO NORDISK AS (DK) 2019-06-12 EP disclosed