SCHEMBL6759259

SCHEMBL6759259

O=C(OC(OCc1cc(OCCCO)cc(OCCCO)c1)c1ccccc1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
GAA P10253 1/20 0.37
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
RRM1 P23921 1/20 0.36
PTGES O14684 1/20 0.35
ALOX5 P09917 1/20 0.35
PPARG P37231 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
MAPT P10636 2/20 0.35
RAB9A P51151 2/20 0.35
POLB P06746 1/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SLC6A3 Q01959 2/20 0.35

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
SCHEMBL3081480 0.80 KMT2A (0.57) KMT2AMEN1GAAESR1ESR2
SCHEMBL3087619 0.78 KMT2A (0.54) KMT2AMEN1GAATDP1MAPT
SCHEMBL29184051 0.76 ESR1 (0.56) KMT2AMEN1ESR1ESR2TDP1
SCHEMBL6759258 0.72 KMT2A (0.43) KMT2AMEN1PPARGTDP1TSHR
SCHEMBL12431070 0.71 KMT2A (0.53) KMT2AMEN1GAAMAPTRAB9A
SCHEMBL828657 0.70 TSHR (0.61) KMT2AMEN1ESR1ESR2TDP1
SCHEMBL6672187 0.69 LMNA (0.50) KMT2AMEN1ESR1ESR2TDP1
SCHEMBL3081596 0.69 KMT2A (0.55) KMT2AMEN1GAAESR1ESR2
SCHEMBL891146 0.66 ESR1 (0.72) KMT2AMEN1ESR1ESR2TP53
SCHEMBL3088947 0.66 KMT2A (0.51) KMT2AMEN1TDP1MAPTRAB9A

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-2004063292-A2 ANTI-FOULING SOL-GEL COATINGS CONTAINING DENDRIMERS THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEWYORK (US) 2004-07-29 WO disclosed