SCHEMBL9129708

SCHEMBL9129708

CC(C)=CCC/C(C)=C\CC(C(=O)O)C(=O)O

nearest known ligand 0.96

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FNTA P49354 5/20 0.96
FNTB P49356 5/20 0.96
KDM4E B2RXH2 1/20 0.57
ATM Q13315 1/20 0.57
KMT2A Q03164 3/20 0.56
ALOX15 P16050 2/20 0.52
MEN1 O00255 2/20 0.52
CYP3A4 P08684 1/20 0.52
ALDH1A1 P00352 2/20 0.52
MAPT P10636 2/20 0.50
POLB P06746 1/20 0.50
TRPA1 O75762 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
SCHEMBL8625937 1.00 FNTA (0.96) FNTAFNTBKDM4EATMKMT2A
SCHEMBL8625931 1.00 FNTA (0.96) FNTAFNTBKDM4EATMKMT2A
SCHEMBL16792146 0.98 FNTA (1.00) FNTAFNTBKDM4EATMKMT2A
SCHEMBL11703920 0.98 FNTA (1.00) FNTAFNTBKDM4EATMKMT2A
SCHEMBL3271383 0.92 FNTA (0.83) FNTAFNTBKDM4EATMKMT2A
SCHEMBL17223965 0.91 FNTA (0.86) FNTAFNTBKDM4EATMKMT2A
SCHEMBL17223966 0.91 FNTA (0.86) FNTAFNTBKDM4EATMKMT2A
SCHEMBL14815638 0.88 FNTA (0.76) FNTAFNTBKDM4EATMKMT2A
SCHEMBL9474585 0.88 FNTA (0.75) FNTAFNTBKDM4EATMKMT2A
SCHEMBL9474569 0.88 FNTA (0.75) FNTAFNTBKDM4EATMKMT2A

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
US-5428028-A Method for lowering cholesterol employing a phosphonomethylphosphinate squalene synthetase inhibitor E. R. SQUIBB & SONS, INC. (US) 1995-06-27 US disclosed
EP-0514124-A2 Use of phosphonomethylphosphinate squalene synthetase inhibitors for the manufacture of a medicament for the lowering cholesterol E.R. SQUIBB & SONS, INC. (US) 1992-11-19 EP disclosed
EP-0513761-A2 Bisphosphonate squalene synthetase inhibitors E.R. SQUIBB & SONS, INC. (US) 1992-11-19 EP disclosed
US-5157027-A Anticholesterol agents E. R. SQUIBB & SONS, INC. (US) 1992-10-20 US disclosed