SCHEMBL13652876

SCHEMBL13652876

OCCc1cc(Cc2cc(CCO)cc(-n3n4c5ccccc5n34)c2O)c(O)c(-n2n3c4ccccc4n23)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.36
▸ BCL2 P10415 1/20 0.33
▸ BCL2L1 Q07817 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ BACE1 P56817 1/20 0.33
▸ HSPA5 P11021 1/20 0.32
▸ PTPN1 P18031 2/20 0.32
▸ PTPN2 P17706 1/20 0.32
▸ PTPN6 P29350 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CCNE1 P24864 1/20 0.30
▸ CDK2 P24941 1/20 0.30
▸ HSF1 Q00613 1/20 0.30

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
SCHEMBL13879921 0.92 AMY1A (0.37) TDP1HSPA5
SCHEMBL12583698 0.88 KDM4E (0.36) BCL2BCL2L1KDM4EALOX5HSPA5
SCHEMBL13891930 0.85 — —
SCHEMBL13840747 0.82 PTGS2 (0.43) KDM4EALDH1A1
SCHEMBL13840739 0.80 PTPN1 (0.53) BCL2BCL2L1ALOX5PTPN1PTPN2
SCHEMBL8055674 0.77 KCNMA1 (0.49) ALDH1A1MAPT
SCHEMBL30112936 0.77 KDM4E (0.46) TDP1KDM4EALDH1A1ALOX5GAA
SCHEMBL342550 0.77 KDM4E (0.46) TDP1KDM4EALDH1A1ALOX5GAA
SCHEMBL12238823 0.77 HPGD (0.39) KDM4EALDH1A1
SCHEMBL13927493 0.76 AMY1A (0.46) BCL2BCL2L1GAAHSPA5PTPN1

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-20090246416-A1 OPTICAL FILM, METHOD OF MANUFACTURING THE SAME, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY DEVICE KONICA MINOLTA OPTO, INC. (JP) 2009-10-01 — — US disclosed
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