SCHEMBL6759258

SCHEMBL6759258

O=C(OCc1ccccc1OCc1cc(OCCCO)cc(OCCCO)c1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A3 Q01959 1/20 0.43
PPARG P37231 1/20 0.43
ABCB1 P08183 2/20 0.43
MEN1 O00255 2/20 0.41
PTGER1 P34995 1/20 0.41
PTGER4 P35408 1/20 0.41
PTGER3 P43115 1/20 0.41
PTGER2 P43116 1/20 0.41
LMNA P02545 2/20 0.40
TSHR P16473 1/20 0.40
MTNR1B P49286 1/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MRGPRX4 Q96LA9 3/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL3087619 0.88 KMT2A (0.54) KMT2ATDP1SLC6A2SLC6A3MEN1
SCHEMBL3081480 0.88 KMT2A (0.57) KMT2ATDP1SLC6A2SLC6A3MEN1
SCHEMBL3081596 0.76 KMT2A (0.55) KMT2ATDP1SLC6A2SLC6A3PPARG
SCHEMBL3088947 0.76 KMT2A (0.51) KMT2ATDP1SLC6A2SLC6A3MEN1
SCHEMBL3087472 0.75 TDP1 (0.54) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL27801073 0.74 KMT2A (0.59) KMT2ATDP1SLC6A2SLC6A3PPARG
SCHEMBL8676387 0.73 PTGER1 (0.62) KMT2ATDP1SLC6A2SLC6A3ABCB1
SCHEMBL6759259 0.72 KMT2A (0.37) KMT2ATDP1SLC6A2SLC6A3PPARG
SCHEMBL8675525 0.72 PTGER1 (0.61) KMT2ATDP1SLC6A2SLC6A3ABCB1
SCHEMBL344616 0.70 TDP1 (0.81) KMT2ATDP1SLC6A2SLC6A3LMNA

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