SCHEMBL8771784

SCHEMBL8771784

CC(C)=CCCC(C)=CCCC(C)=CC(=O)C(F)(F)C(F)(F)O[PH](=O)OC(F)(F)C(F)(F)C(=O)C=C(C)CCC=C(C)CCC=C(C)C

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
ATM Q13315 1/20 0.44
POLB P06746 1/20 0.43
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 2/20 0.41
ALOX15 P16050 2/20 0.41
MAPT P10636 3/20 0.40
MEN1 O00255 2/20 0.40
TRPA1 O75762 1/20 0.40
FNTA P49354 3/20 0.40
FNTB P49356 3/20 0.40
SQLE Q14534 3/20 0.40
CYP3A4 P08684 1/20 0.39
UGT1A1 P22309 1/20 0.39
GGPS1 O95749 1/20 0.38

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
SCHEMBL9113453 1.00 KDM4E (0.44) KDM4EATMPOLBKMT2AALDH1A1
SCHEMBL9113458 0.91 KDM4E (0.43) KDM4EATMPOLBKMT2AALDH1A1
SCHEMBL8771641 0.80 GGPS1 (0.43) KDM4EATMPOLBKMT2AFNTA
SCHEMBL8771732 0.78 KDM4E (0.44) KDM4EATMPOLBKMT2AALDH1A1
SCHEMBL8771720 0.78 KDM4E (0.44) KDM4EATMPOLBKMT2AALDH1A1
SCHEMBL8771686 0.78 KDM4E (0.44) KDM4EATMPOLBKMT2AALDH1A1
SCHEMBL8908589 0.76 KDM4E (0.55) KDM4EATMPOLBKMT2AALDH1A1
SCHEMBL8908593 0.76 KDM4E (0.55) KDM4EATMPOLBKMT2AALDH1A1
SCHEMBL8908580 0.76 KDM4E (0.55) KDM4EATMPOLBKMT2AALDH1A1
SCHEMBL8771778 0.75 GGPS1 (0.54) KDM4EATMFNTAFNTBGGPS1

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
EP-0686159-B1 FARNESYL:PROTEIN TRANSFERASE INHIBITORS AS ANTICANCER AGENTS MERRELL PHARMA INC (US) 1997-10-08 EP disclosed
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