SCHEMBL16865507

SCHEMBL16865507

c1c(CN(CC2CO2)CC2CO2)cc(CN(CC2CO2)C[C@@H]2CO2)cc1CN(CC1CO1)CC1CO1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
ALDH1A1 P00352 2/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
POLB P06746 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL11036254 1.00 LMNA (0.33) LMNAALDH1A1TP53CYP3A4TSHR
SCHEMBL18900935 0.90 MEN1 (0.30) MEN1KMT2A
SCHEMBL44458 0.88 ALDH1A1 (0.39) LMNAALDH1A1TP53CYP3A4TSHR
SCHEMBL15314659 0.88 ALDH1A1 (0.39) LMNAALDH1A1TP53CYP3A4TSHR
SCHEMBL1472102 0.81 LMNA (0.44) LMNAALDH1A1TSHRMEN1KMT2A
SCHEMBL24085992 0.80 OPRM1 (0.44)
SCHEMBL1893856 0.79 OPRK1 (0.43)
SCHEMBL1323564 0.77 LMNA (0.44) LMNAALDH1A1TSHRMEN1KMT2A
SCHEMBL13737372 0.77 LMNA (0.44) LMNAALDH1A1TSHRMEN1KMT2A
SCHEMBL15050220 0.77 LMNA (0.44) LMNAALDH1A1TSHRMEN1KMT2A

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-20150189745-A1 EPOXY RESIN COMPOSITION, AND, PREPREG AND COPPER CLAD LAMINATE MANUFACTURED USING THE COMPOSITION SHENGYI TECHNOLOGY CO., LTD. (CN) 2015-07-02 US disclosed