SCHEMBL20197662

SCHEMBL20197662

O=C(O)CCCCCCCCCCC/C=C\CO

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.67
PPARD Q03181 5/20 0.67
PPARA Q07869 5/20 0.67
F7 P08709 5/20 0.67
F3 P13726 5/20 0.67
MAPT P10636 4/20 0.67
HSD17B10 Q99714 4/20 0.67
TERT O14746 3/20 0.67
PTPN1 P18031 3/20 0.67
BLM P54132 3/20 0.67
FABP4 P15090 3/20 0.67
LMNA P02545 3/20 0.67
ALOX15 P16050 3/20 0.67
CYP19A1 P11511 3/20 0.67
PTGS1 P23219 3/20 0.67
TDP1 Q9NUW8 3/20 0.67
RECQL P46063 2/20 0.67
DUSP3 P51452 2/20 0.67
NR4A2 P43354 2/20 0.67
KMT2A Q03164 2/20 0.67

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
SCHEMBL4449624 1.00 PPARG (0.67) PPARGPPARDPPARAF7F3
SCHEMBL5379264 1.00 PPARG (0.67) PPARGPPARDPPARAF7F3
SCHEMBL5379268 1.00 PPARG (0.67) PPARGPPARDPPARAF7F3
SCHEMBL28304955 1.00 PPARG (0.67) PPARGPPARDPPARAF7F3
SCHEMBL16308004 1.00 PPARG (0.67) PPARGPPARDPPARAF7F3
SCHEMBL4449623 1.00 PPARG (0.67) PPARGPPARDPPARAF7F3
SCHEMBL16523047 1.00 PPARG (0.67) PPARGPPARDPPARAF7F3
SCHEMBL15320686 1.00 PPARG (0.67) PPARGPPARDPPARAF7F3
SCHEMBL8984377 0.98 PPARG (0.63) PPARGPPARDPPARAF7F3
SCHEMBL8327969 0.98 PPARG (0.63) PPARGPPARDPPARAF7F3

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-2835425-B1 Use of BVMO (Baeyer-Villiger monooxygenases) and fatty acids UNIV EWHA IND COLLABORATION (KR) 2018-05-30 EP disclosed