SCHEMBL8661187

SCHEMBL8661187

CCCCC(=O)OCCOC(C)OC=Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.40
RECQL P46063 1/20 0.40
KMT2A Q03164 1/20 0.40
DGKA P23743 1/20 0.40
TDP1 Q9NUW8 2/20 0.40
BCHE P06276 3/20 0.38
PPARA Q07869 1/20 0.38
PTGES O14684 1/20 0.38
ALOX5 P09917 1/20 0.38
PPARG P37231 1/20 0.38
ACHE P22303 2/20 0.37
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
AKR1C3 P42330 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
CTSK P43235 1/20 0.37
TOP2A P11388 1/20 0.37

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
SCHEMBL8664460 0.88 ALDH1A1 (0.39) KDM4EMEN1KMT2ATDP1BCHE
SCHEMBL8662776 0.82 ALDH1A1 (0.40) MEN1KMT2ATDP1
SCHEMBL27620966 0.82 RELA (0.40) KDM4EMEN1KMT2ATDP1BCHE
SCHEMBL4543866 0.79 MEN1 (0.39) KDM4EMEN1KMT2ATDP1
SCHEMBL11819983 0.75 KDM4E (0.48) KDM4EMEN1RECQLKMT2ATDP1
SCHEMBL11819973 0.75 KDM4E (0.48) KDM4EMEN1RECQLKMT2ATDP1
SCHEMBL1395549 0.73 RELA (0.44) KDM4EMEN1KMT2ATDP1PPARA
SCHEMBL27842258 0.73 TDP1 (0.50) KDM4EMEN1RECQLKMT2ATDP1
SCHEMBL1305900 0.72 MMP1 (0.47) KDM4EMEN1RECQLKMT2ATDP1
SCHEMBL1305901 0.72 MMP1 (0.47) KDM4EMEN1RECQLKMT2ATDP1

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-5852128-A Acid-labile group protected hydroxystyrene polymers or copolymers thereof and their application to radiation sensitive materials CLARIANT AG (CH) 1998-12-22 US disclosed