SCHEMBL2032263

SCHEMBL2032263

O=C(O)CCC(=O)OC(=O)CCC(=O)OCC(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.42
LMNA P02545 5/20 0.38
EGLN1 Q9GZT9 4/20 0.36
KDM6B O15054 2/20 0.36
KDM5C P41229 2/20 0.36
PHF8 Q9UPP1 2/20 0.36
KDM2A Q9Y2K7 2/20 0.36
ALKBH5 Q6P6C2 1/20 0.36
SUCNR1 Q9BXA5 1/20 0.36
ALDH1A1 P00352 4/20 0.34
POLB P06746 2/20 0.33
FABP7 O15540 1/20 0.32
TSHR P16473 2/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
HSD17B10 Q99714 1/20 0.30
KDM4E B2RXH2 1/20 0.30
SLC15A2 Q16348 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
SCHEMBL9592005 0.94 HTT (0.46) HTTLMNAEGLN1KDM6BKDM5C
Succinic Acid SCHEMBL2032259 0.94 HTT (0.46) HTTLMNAEGLN1KDM6BKDM5C
SCHEMBL4951808 0.85 HTT (0.54) HTTLMNAALDH1A1POLBFABP7
SCHEMBL28068757 0.82 TSHR (0.48) HTTLMNAALDH1A1TSHRGAA
SCHEMBL9449439 0.82 LMNA (0.46) HTTLMNAALDH1A1TSHRMEN1
SCHEMBL30089474 0.78 LMNA (0.39) HTTLMNAEGLN1KDM6BKDM5C
SCHEMBL1992862 0.78 LMNA (0.60) LMNAEGLN1KDM6BKDM5CPHF8
SCHEMBL288701 0.78 LMNA (0.60) LMNAEGLN1KDM6BKDM5CPHF8
SCHEMBL16125337 0.77 LMNA (0.33) HTTLMNAEGLN1KDM6BKDM5C
SCHEMBL509013 0.76 HTT (0.50) HTTLMNAALDH1A1TSHRMAPT

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
WO-2011068403-A2 NOVEL N-{3-ETHYNYLPHENYLAMINO)-6,7-BIS(2-METHOXYETHOXY)-4-QUINAZOLINAMJNE SALTS ULTIMORPHIX TECHNOLOGIES B.V. (NL) 2011-06-09 WO claimed