SCHEMBL4453425

SCHEMBL4453425

Cc1c(C)c(C)c(-c2c(O)ccc3c2O3)c(O)c1C

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SYNJ2 O15056 2/20 0.32
SENP1 Q9P0U3 1/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
PTGS2 P35354 1/20 0.31
POLB P06746 2/20 0.30
MEN1 O00255 1/20 0.30
APEX1 P27695 1/20 0.30
RECQL P46063 1/20 0.30
CACNA1B Q00975 1/20 0.30
APBA1 Q02410 1/20 0.30
KMT2A Q03164 1/20 0.30
MCL1 Q07820 1/20 0.30
CTDSP1 Q9GZU7 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CRHBP P24387 1/20 0.30
CRHR2 Q13324 1/20 0.30
ABCG2 Q9UNQ0 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
SCHEMBL33480 0.73
SCHEMBL1552332 0.72 TRPA1 (0.38) SENP1ESR1ESR2POLBMEN1
SCHEMBL30301367 0.71 ESR2 (0.41) ESR1ESR2PTGS2
SCHEMBL992964 0.69 SENP1 (0.39) SENP1
SCHEMBL1856942 0.69
Formaldehyde SCHEMBL9717809 0.68 ESR2 (0.39) ESR1ESR2
SCHEMBL10807822 0.68
SCHEMBL10363177 0.68 ALDH1A1 (0.34) SENP1POLBL3MBTL1
SCHEMBL10633407 0.65 GNG2 (0.40) RECQL
SCHEMBL33479 0.65

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
EP-1566395-B1 FLAME-RETARDANT EPOXY RESIN COMPOSITION AND CURED OBJECT OBTAINED THEREFROM NIPPON KAYAKU KK (JP) 2009-03-11 EP claimed