SCHEMBL8908593

SCHEMBL8908593

CC(C)=CCCC(C)=CCCC(C)=CC(=O)C(C)(F)F

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.55
ATM Q13315 1/20 0.55
KMT2A Q03164 3/20 0.53
POLB P06746 1/20 0.53
FNTA P49354 3/20 0.49
FNTB P49356 3/20 0.49
ALOX15 P16050 4/20 0.48
MAPT P10636 2/20 0.48
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 2/20 0.48
CYP3A4 P08684 2/20 0.48
UGT1A1 P22309 1/20 0.48
SQLE Q14534 1/20 0.47
GGPS1 O95749 1/20 0.46

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
SCHEMBL8908589 0.86 KDM4E (0.55) KDM4EATMKMT2APOLBFNTA
SCHEMBL8908580 0.86 KDM4E (0.55) KDM4EATMKMT2APOLBFNTA
SCHEMBL794369 0.84 KDM4E (0.60) KDM4EATMKMT2APOLBFNTA
SCHEMBL794370 0.84 KDM4E (0.60) KDM4EATMKMT2APOLBFNTA
SCHEMBL9116583 0.83 KDM4E (0.51) KDM4EATMKMT2APOLBFNTA
SCHEMBL8771577 0.81 GGPS1 (0.56) KDM4EATMKMT2APOLBFNTA
SCHEMBL8771582 0.81 GGPS1 (0.56) KDM4EATMKMT2APOLBFNTA
SCHEMBL8771778 0.79 GGPS1 (0.54) KDM4EATMFNTAFNTBGGPS1
SCHEMBL8771800 0.79 GGPS1 (0.50) FNTAFNTBGGPS1
SCHEMBL9881031 0.77 KMT2A (0.67) KDM4EATMKMT2APOLBFNTA

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 2 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
US-5463181-A Farnesyl: protein transferase inhibitors as anticancer agents MERRELL DOW PHARMACEUTICALS INC. (US) 1995-10-31 US disclosed