SCHEMBL6026977

SCHEMBL6026977

COC(=O)/C=C/c1ccc(OCCCCCCOc2cc(COc3cc(OCc4cc(OCCCCCCOc5ccc(/C=C/C(=O)OC)cc5OC)cc(OCCCCCCOc5ccc(/C=C/C(=O)OC)cc5OC)c4)cc(C(=O)OCCCCCCCCCCCOC(=O)c4cc(N)cc(N)c4)c3)cc(OCCCCCCOc3ccc(/C=C/C(=O)OC)cc3OC)c2)c(OC)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FDPS P14324 3/20 0.54
ACHE P22303 10/20 0.47
BCHE P06276 7/20 0.47
MET P08581 1/20 0.43
ABCB1 P08183 2/20 0.43
ABCC1 P33527 2/20 0.43
ABCG2 Q9UNQ0 2/20 0.43
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
APP P05067 2/20 0.42

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
SCHEMBL6026984 1.00 FDPS (0.54) FDPSACHEBCHEMETABCB1
SCHEMBL6026361 1.00 FDPS (0.54) FDPSACHEBCHEMETABCB1
SCHEMBL6026047 1.00 FDPS (0.54) FDPSACHEBCHEMETABCB1
SCHEMBL6026347 1.00 FDPS (0.54) FDPSACHEBCHEMETABCB1
SCHEMBL6026710 1.00 FDPS (0.54) FDPSACHEBCHEMETABCB1
SCHEMBL6026041 1.00 FDPS (0.54) FDPSACHEBCHEMETABCB1
SCHEMBL6026703 1.00 FDPS (0.54) FDPSACHEBCHEMETABCB1
SCHEMBL6026206 0.98 FDPS (0.54) FDPSACHEBCHEMETKDM4E
SCHEMBL6026198 0.98 FDPS (0.54) FDPSACHEBCHEMETKDM4E
SCHEMBL6439102 0.94 FDPS (0.52) FDPSACHEBCHEMETABCB1

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
US-7034098-B2 POlyimide, polyamide; liquid crystals, opticsoptics ROLIC AG (CH) 2006-04-25 US disclosed
EP-1368411-B1 PHOTOACTIVE POLYMER ROLIC AG (CH) 2005-07-06 EP disclosed
US-20040185215-A1 Photoactive polymer based on polyimides, polyamic acids and esters characterised in that it contains as a side-chain a dendritic block incorporating photoactive groups at its surface; use as orientation layers for liquid crystals and in the construction of unstructured and structured optical elements ROLIC AG (CH) 2004-09-23 US disclosed