SCHEMBL7744907

SCHEMBL7744907

COC(=O)c1ccc2cc(C(=O)OC)ccc2c1.COC(=O)c1cccc(C(=O)OC)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 2/20 0.65
PLAU P00749 7/20 0.61
TSHR P16473 1/20 0.57
LCK P06239 1/20 0.57
CYP19A1 P11511 1/20 0.56
CYP11B1 P15538 1/20 0.56
CYP11B2 P19099 1/20 0.56
LOXL2 Q9Y4K0 1/20 0.56
ALOX15 P16050 1/20 0.56
HTT P42858 1/20 0.56
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
CA12 O43570 1/20 0.55
CA7 P43166 1/20 0.55
XDH P47989 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
PLAT P00750 2/20 0.55
PLG P00747 1/20 0.55
CYP4F2 P78329 1/20 0.54

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
SCHEMBL7744919 0.93 KDM4E (0.59) PTPN11PLAUTSHRLCKCYP19A1
SCHEMBL29365729 0.92 PTPN11 (0.68) PTPN11PLAUTSHRLCKCYP19A1
SCHEMBL69025 0.92 PTPN11 (0.68) PTPN11PLAUTSHRLCKCYP19A1
SCHEMBL8732524 0.90 PTPN11 (0.66) PTPN11PLAUTSHRLCKCYP19A1
SCHEMBL427151 0.90 TSHR (0.71) TSHRLOXL2CA1CA2CA12
SCHEMBL34953 0.89 TSHR (0.70) TSHRLOXL2CA1CA2CA12
SCHEMBL1003761 0.88 KDM4E (0.62) PTPN11PLAUTSHRLCKCYP19A1
SCHEMBL9979782 0.88 PTPN11 (0.64) PTPN11PLAUTSHRLCKCYP19A1
SCHEMBL8054504 0.87 TSHR (0.67) TSHRLOXL2CA1CA2CA12
SCHEMBL10941453 0.87 TSHR (0.67) TSHRLOXL2CA1CA2CA12

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