SCHEMBL7568873

SCHEMBL7568873

COC(=O)c1cc(O)c2cc(OC)cc(OC)c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 2/20 0.51
KDM4E B2RXH2 2/20 0.51
POLB P06746 2/20 0.51
GAA P10253 2/20 0.51
LMNA P02545 1/20 0.51
NFKB1 P19838 1/20 0.51
GFER P55789 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
FUT7 Q11130 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
CNR2 P34972 2/20 0.48
PTPN11 Q06124 1/20 0.46
CYP3A4 P08684 3/20 0.45
USP2 O75604 1/20 0.45
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45

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
SCHEMBL28964183 0.86 PTGS2 (0.57) KDM4ELMNAFUT7TDP1CYP3A4
SCHEMBL30076482 0.82 SMN1; SMN2 (0.48) POLBCNR2CYP3A4USP2MAPK1
SCHEMBL7574341 0.82 SMN1; SMN2 (0.48) POLBCNR2CYP3A4USP2MAPK1
SCHEMBL7789713 0.79 FTO (0.53) XDHKDM4EPOLBGAALMNA
SCHEMBL6043174 0.78 FTO (0.52) XDHKDM4EPOLBGAALMNA
SCHEMBL1844411 0.75 LCK (0.55) XDHKDM4EPOLBGAALMNA
SCHEMBL5069079 0.75 CYP3A4 (0.45) KDM4EPOLBGAAL3MBTL1CYP3A4
SCHEMBL30594704 0.74 KDM4E (0.77) XDHKDM4EPOLBGAALMNA
SCHEMBL1465618 0.74 KDM4E (0.77) XDHKDM4EPOLBGAALMNA
SCHEMBL6132065 0.74 PTPN11 (0.58) XDHKDM4EPOLBGAALMNA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0984929-B1 NAPHTHOPYRAN DERIVATIVES, COMPOSITIONS AND (CO)POLYMER MATRICES CONTAINING THE SAME CORNING SA (FR) 2002-09-11 EP disclosed
US-6399791-B1 PHOTOCHROMISM CORNING S.A. (FR) 2002-06-04 US disclosed
CN-1250438-A Naphthopyran derivatives, compositions and polymer matrices containing them CORNING INC (US) 2000-04-12 CN disclosed
EP-0984929-A1 NAPHTHOPYRAN DERIVATIVES, COMPOSITIONS AND (CO)POLYMERS MATRICES CONTAINING SAME CORNING INCORPORATED (US) 2000-03-15 EP disclosed
EP-0984929-A4 NAPHTHOPYRAN DERIVATIVES, COMPOSITIONS AND (CO)POLYMERS MATRICES CONTAINING SAME CORNING INC (US) 2000-03-15 EP disclosed
WO-1998042663-A1 NAPHTHOPYRAN DERIVATIVES, COMPOSITIONS AND (CO)POLYMERS MATRICES CONTAINING SAME CORNING INCORPORATED (US) 1998-10-01 WO disclosed