SCHEMBL3467327

SCHEMBL3467327

C=C(C(=O)O)C(C)C=C(CCCCCCCCCCC)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.41
PPARG P37231 7/20 0.41
PPARD Q03181 7/20 0.41
PPARA Q07869 7/20 0.41
HDAC11 Q96DB2 5/20 0.41
TSHR P16473 4/20 0.41
PTPN1 P18031 3/20 0.41
ALDH1A1 P00352 2/20 0.41
TLR2 O60603 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
FABP4 P15090 2/20 0.41
MEN1 O00255 2/20 0.41
ALOX15 P16050 2/20 0.41
KMT2A Q03164 2/20 0.41
HSD17B10 Q99714 2/20 0.41
SLC22A6 Q4U2R8 1/20 0.41
SLC22A8 Q8TCC7 1/20 0.41
ESR1 P03372 1/20 0.41
PDE4A P27815 1/20 0.41
PDE3A Q14432 1/20 0.41

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
SCHEMBL9336189 1.00 GPR84 (0.41) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL3634989 0.98 AKR1B1 (0.39) GPR84PPARGPPARDPPARAHDAC11
Methacrylic Acid SCHEMBL7696921 0.94 FNTA (0.37) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL158481 0.93 APEX1 (0.36) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL8230756 0.86 GRIK1 (0.33)
Styrene SCHEMBL3968403 0.84 LMNA (0.43) PPARGTSHRALDH1A1TDP1MEN1
SCHEMBL8139925 0.83 CAMK2A (0.34)
SCHEMBL9307808 0.83 FAAH (0.32) MEN1KMT2AHSD17B10CYP1A2FAAH
SCHEMBL8355107 0.83 GPR84 (0.40) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL1133777 0.82 ALDH1A1 (0.40) TSHRALDH1A1APEX1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010076717-A1 ION-SELECTIVE SOLID CONTACT MICROELECTRODE AND ITS PRODUCTION METHOD UNIVERSIDADE DE AVEIRO (PT) 2010-07-08 WO disclosed
EP-1864114-A1 DOPED SILICA MICROSPHERE OPTICAL ION SENSORS Beckman Coulter, Inc. (US) 2007-12-12 EP disclosed
US-20060240560-A1 Microsphere optical ion sensors based on doped silica gel templates AUBURN UNIVERSITY 2006-10-26 US disclosed
WO-2006083960-A1 DOPED SILICA MICROSPHERE OPTICAL ION SENSORS BECKMAN COULTER, INC. (US) 2006-08-10 WO disclosed