SCHEMBL5478606

SCHEMBL5478606

CCC=CC=C(C)C(=O)OC

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.37
ALDH1A1 P00352 2/20 0.36
GLO1 Q04760 1/20 0.33
OXER1 Q8TDS5 1/20 0.33
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
TET2 Q6N021 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30
RECQL P46063 1/20 0.30

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
SCHEMBL29188769 0.86 TAS1R3 (0.37) ALDH1A1GLO1RECQL
SCHEMBL3830095 0.83 TRPA1 (0.37) TRPA1GLO1
SCHEMBL8582231 0.81 ALDH1A1 (0.42) ALDH1A1MGAMGAASIMGAM2
SCHEMBL8582235 0.81 ALDH1A1 (0.42) ALDH1A1MGAMGAASIMGAM2
SCHEMBL8581126 0.81 FASN (0.46) ALDH1A1RECQL
SCHEMBL8581124 0.81 FASN (0.46) ALDH1A1RECQL
SCHEMBL8582738 0.80 FASN (0.49) RECQL
SCHEMBL28050294 0.80 FASN (0.49) RECQL
SCHEMBL10429890 0.80 FASN (0.49) RECQL
SCHEMBL18097887 0.80 FASN (0.49) RECQL

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-7247697-B2 Coating compositions for use in golf balls ACUSHNET COMPANY (US) 2007-07-24 US disclosed
US-20060089419-A1 Coating compositions for use in golf balls JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2006-04-27 US disclosed