SCHEMBL8909844

SCHEMBL8909844

CC(C)=CCCC(C)=CCCC(C)=CC(=O)CO[PH](=O)O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
ATM Q13315 1/20 0.49
POLB P06746 1/20 0.47
KMT2A Q03164 3/20 0.47
ALDH1A1 P00352 3/20 0.45
ALOX15 P16050 2/20 0.45
FNTA P49354 5/20 0.44
FNTB P49356 5/20 0.44
MAPT P10636 3/20 0.43
MEN1 O00255 2/20 0.43
CYP3A4 P08684 1/20 0.43
UGT1A1 P22309 1/20 0.43
SQLE Q14534 1/20 0.42
TRPA1 O75762 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
SCHEMBL8909842 0.89 KDM4E (0.50) KDM4EATMPOLBKMT2AALDH1A1
SCHEMBL8909848 0.89 KDM4E (0.50) KDM4EATMPOLBKMT2AALDH1A1
SCHEMBL8771729 0.79 KDM4E (0.43) KDM4EATMPOLBKMT2AALDH1A1
SCHEMBL27740873 0.79 ALDH1A1 (0.56) KMT2AALDH1A1ALOX15FNTAFNTB
SCHEMBL16664314 0.79 ALDH1A1 (0.56) KMT2AALDH1A1ALOX15FNTAFNTB
SCHEMBL8771709 0.79 KDM4E (0.49) KDM4EATMPOLBKMT2AALDH1A1
SCHEMBL29748905 0.77 ALDH1A1 (0.58) KMT2AALDH1A1ALOX15FNTAFNTB
SCHEMBL31166044 0.75 ALDH1A1 (0.51) KMT2AALDH1A1ALOX15FNTAFNTB
SCHEMBL31166045 0.75 ALDH1A1 (0.51) KMT2AALDH1A1ALOX15FNTAFNTB
SCHEMBL8771714 0.75 FNTA (0.50) FNTAFNTB

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-5665715-A Farnesyl:protein transferase inhibitors as anticancer agents MERRELL PHARMACEUTICALS INC. (US) 1997-09-09 US disclosed
EP-0686159-A1 FARNESYL:PROTEIN TRANSFERASE INHIBITORS AS ANTICANCER AGENTS MERRELL DOW PHARMA (US) 1995-12-13 EP disclosed
US-5463181-A Farnesyl: protein transferase inhibitors as anticancer agents MERRELL DOW PHARMACEUTICALS INC. (US) 1995-10-31 US disclosed
WO-1994019357-A1 FARNESYL:PROTEIN TRANSFERASE INHIBITORS AS ANTICANCER AGENTS MERRELL DOW PHARMACEUTICALS INC. (US) 1994-09-01 WO disclosed