SCHEMBL7087960

SCHEMBL7087960

CCCCC=C(C)C(=O)OC(C)C

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
TSHR P16473 2/20 0.37
GRIK1 P39086 1/20 0.37
EP300 Q09472 1/20 0.36
FAAH O00519 4/20 0.36
CTSK P43235 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
ALDH1A1 P00352 1/20 0.32
ALOX15 P16050 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
F7 P08709 1/20 0.32
F3 P13726 1/20 0.32

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
SCHEMBL29117916 0.95 LMNA (0.46) LMNATSHREP300FAAHALDH1A1
Fluoride SCHEMBL28037720 0.93 LMNA (0.44) LMNATSHREP300FAAHALDH1A1
SCHEMBL27681486 0.89 TSHR (0.39) LMNATSHRGRIK1FAAHCYP2D6
SCHEMBL27885960 0.87 LMNA (0.37) LMNATSHRGRIK1EP300FAAH
Acrylic Acid SCHEMBL28190282 0.86 EP300 (0.40) LMNATSHREP300FAAH
SCHEMBL27740651 0.86 GRIK1 (0.41) LMNATSHRGRIK1EP300FAAH
SCHEMBL27885953 0.84 GRIK1 (0.34) LMNATSHRGRIK1EP300FAAH
SCHEMBL28987152 0.82 LMNA (0.39) LMNAEP300FAAHCYP2D6CYP2C19
SCHEMBL27431868 0.81 TSHR (0.39) TSHRCYP2D6CYP2C19ALDH1A1ALOX15
SCHEMBL1594945 0.81 GRIK1 (0.34) LMNAGRIK1EP300FAAHCTSK

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
US-20030019813-A1 Antimicrobial polymer foams with amino alcohols DE GUSSA AG (DE) 2003-01-30 US disclosed