SCHEMBL6748178

SCHEMBL6748178

CC(C)=CCCC(C)=CCC(C(=O)O)=C(CC=C(C)CCC=C(C)C)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FNTA P49354 5/20 0.57
FNTB P49356 5/20 0.57
KDM4E B2RXH2 1/20 0.57
ATM Q13315 1/20 0.57
KMT2A Q03164 4/20 0.56
POLB P06746 1/20 0.55
ALOX15 P16050 3/20 0.52
MEN1 O00255 3/20 0.52
CYP3A4 P08684 2/20 0.52
ALDH1A1 P00352 3/20 0.52
MAPT P10636 3/20 0.50
TRPA1 O75762 1/20 0.50
UGT1A1 P22309 1/20 0.50
SQLE Q14534 1/20 0.48

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
SCHEMBL6748177 1.00 FNTA (0.57) FNTAFNTBKDM4EATMKMT2A
SCHEMBL5362514 0.91 FNTA (0.53) FNTAFNTBKDM4EATMKMT2A
SCHEMBL1409916 0.83 FNTA (0.66) FNTAFNTBKDM4EATMKMT2A
SCHEMBL806737 0.83 FNTA (0.66) FNTAFNTBKDM4EATMKMT2A
SCHEMBL5361163 0.83 FNTA (0.66) FNTAFNTBKDM4EATMKMT2A
SCHEMBL11465848 0.82 KMT2A (0.54) FNTAFNTBKDM4EATMKMT2A
SCHEMBL11483048 0.82 KMT2A (0.54) FNTAFNTBKDM4EATMKMT2A
SCHEMBL15315193 0.82 FNTA (0.69) FNTAFNTBKDM4EATMKMT2A
SCHEMBL1105228 0.82 FNTA (0.69) FNTAFNTBKDM4EATMKMT2A
SCHEMBL2921177 0.82 FNTA (0.69) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1043968-B1 ANTIMICROBIAL PERFUME COMPOSITIONS FIRMENICH & CIE (CH) 2004-09-15 EP claimed