SCHEMBL3270892

SCHEMBL3270892

C=C(C)COC(CC)CCCc1c(C(=O)O)ccc(C(=O)O)c1C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC37A4 O43826 1/20 0.32
PPARA Q07869 2/20 0.31
PPARG P37231 1/20 0.31
RARB P10826 1/20 0.30
PLK1 P53350 1/20 0.30

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
SCHEMBL5532744 0.92 SLC37A4 (0.35) SLC37A4PPARAPPARGRARBPLK1
SCHEMBL20913253 0.90 PPARA (0.39) SLC37A4PPARAPPARGRARBPLK1
SCHEMBL3270897 0.83 SLC37A4 (0.32) SLC37A4
SCHEMBL5532749 0.78 SLC37A4 (0.35) SLC37A4PPARAPPARGRARB
SCHEMBL5523394 0.76 PDE4A (0.34) PPARAPPARGRARBPLK1
SCHEMBL20913248 0.76 ALDH1A1 (0.40) SLC37A4PPARAPPARGRARB
SCHEMBL5532017 0.74 ALDH1A1 (0.33) PPARAPPARG
Methacrylic Acid SCHEMBL28189910 0.72 GABRP (0.42) SLC37A4PPARAPPARGRARB
SCHEMBL5522601 0.71 ALDH1A1 (0.34)
SCHEMBL5072798 0.71 GABRP (0.49) SLC37A4PPARAPPARGRARB

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-0694298-B1 PREFORMED GLASS IONOMER FILLER WHICH CAN SUSTAINEDLY RELEASE FLUORIDE ION AND DENTAL COMPOSITION CONTAINING THE SAME SHOFU INC (JP) 2010-06-09 EP disclosed