SCHEMBL7108757

SCHEMBL7108757

O=C1OCCOC(=O)c2ccc1cc2.O=C1OCCOC(=O)c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.46
MAOB P27338 2/20 0.46
ALOX15 P16050 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PKM P14618 1/20 0.40
TSHR P16473 1/20 0.40
ITGB2 P05107 1/20 0.40
ICAM1 P05362 1/20 0.40
ITGAL P20701 1/20 0.40
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
CDC25B P30305 2/20 0.38
PTPRC P08575 2/20 0.37
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
LMNA P02545 4/20 0.36
KDM4E B2RXH2 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
POLB P06746 3/20 0.36
HTT P42858 3/20 0.36

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
SCHEMBL11620855 0.91 MAOA (0.43) MAOAMAOBALOX15TDP1PKM
SCHEMBL3733365 0.90 ALOX15 (0.55) MAOAMAOBALOX15TDP1PKM
Hydrochloric Acid SCHEMBL23174308 0.87 ALOX15 (0.52) MAOAMAOBALOX15TDP1PKM
SCHEMBL1434255 0.87 ALOX15 (0.52) MAOAMAOBALOX15TDP1PKM
SCHEMBL17628649 0.87 ITGB2 (0.43) MAOAMAOBTSHRITGB2ICAM1
SCHEMBL3874923 0.87 ITGB2 (0.43) MAOAMAOBTSHRITGB2ICAM1
SCHEMBL22419 0.87 ITGB2 (0.43) MAOAMAOBTSHRITGB2ICAM1
SCHEMBL9706415 0.85 ITGB2 (0.41) MAOAMAOBTSHRITGB2ICAM1
SCHEMBL21436797 0.85 ITGB2 (0.41) MAOAMAOBTSHRITGB2ICAM1
SCHEMBL29958439 0.85 ITGB2 (0.41) MAOAMAOBTSHRITGB2ICAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1078200-B1 LIGHT REFLECTIVE FILM AND LIGHT EMITTING APPARATUS MINNESOTA MINING & MFG (US) 2003-10-01 EP disclosed
EP-1078200-A1 LIGHT REFLECTIVE FILM AND LIGHT EMITTING APPARATUS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 2001-02-28 EP disclosed
WO-1999060303-A1 LIGHT REFLECTIVE FILM AND LIGHT EMITTING APPARATUS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-11-25 WO disclosed