SCHEMBL7745405

SCHEMBL7745405

COC(=O)CCCCC(=O)OC.COC(=O)c1ccc2cc(C(=O)OC)ccc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.58
ALDH1A1 P00352 4/20 0.58
HSD17B10 Q99714 3/20 0.58
KDM4E B2RXH2 2/20 0.58
GAA P10253 2/20 0.58
PTPN11 Q06124 2/20 0.54
LCK P06239 1/20 0.51
CA1 P00915 3/20 0.49
CA2 P00918 3/20 0.49
CA12 O43570 2/20 0.49
CA7 P43166 2/20 0.49
CA9 Q16790 2/20 0.49
CA14 Q9ULX7 2/20 0.49
XDH P47989 1/20 0.49
NR1H4 Q96RI1 1/20 0.48
CYP19A1 P11511 1/20 0.48
CYP11B1 P15538 1/20 0.48
CYP11B2 P19099 1/20 0.48
TSHR P16473 1/20 0.47
HTT P42858 2/20 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
SCHEMBL16197954 0.87 MAPT (0.57) MAPTALDH1A1HSD17B10KDM4EGAA
SCHEMBL69025 0.85 PTPN11 (0.68) MAPTALDH1A1HSD17B10KDM4EGAA
SCHEMBL29365729 0.85 PTPN11 (0.68) MAPTALDH1A1HSD17B10KDM4EGAA
SCHEMBL8732524 0.83 PTPN11 (0.66) MAPTALDH1A1HSD17B10KDM4EGAA
SCHEMBL9979782 0.81 PTPN11 (0.64) MAPTALDH1A1HSD17B10KDM4EGAA
SCHEMBL7230782 0.81 HDAC1 (0.65) ALDH1A1HSD17B10KDM4ENR1H4HPGD
SCHEMBL4946716 0.80 HDAC6 (0.51) MAPTALDH1A1HSD17B10KDM4EGAA
SCHEMBL5187570 0.80 MAPT (0.72) MAPTALDH1A1HSD17B10KDM4EGAA
SCHEMBL9365890 0.80 ALDH1A1 (0.67) MAPTALDH1A1HSD17B10KDM4ELMNA
SCHEMBL709231 0.79 LCK (0.62) MAPTALDH1A1HSD17B10KDM4EGAA

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-6232054-B1 TEAR STRENGTH IN THE TRANSVERSE DIRECTION (TD) OF 10 TO 100 G, A BREAK STRENGTH IN TD OF 10 TO 40 KG/MM.2, A BREAK STRENGTH IN THE MACHINE DIRECTION (MD) OF 2 TO 25 KG/MM.2 AND A THICKNESS UNEVENNESS IN MD OF 0 TO 8 MU.M. FUJI PHOTO FILM CO., LTD. (JP) 2001-05-15 US disclosed