SCHEMBL2273560

SCHEMBL2273560

O=C(O)c1cc(OC(=O)c2cc(O)cc(O)c2)cc(OC(=O)c2cc3ccccc3cc2O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
NSD2 O96028 1/20 0.48
MAPT P10636 6/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
TDP1 Q9NUW8 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
CHRM1 P11229 1/20 0.43
TBXA2R P21731 1/20 0.43
SLC6A2 P23975 1/20 0.43
PDE4A P27815 1/20 0.43

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
SCHEMBL3667804 0.93 SMN1; SMN2 (0.49) MEN1KMT2ANSD2MAPTCA12
SCHEMBL618766 0.82 CA12 (0.61) MEN1KMT2ANSD2MAPTCA12
SCHEMBL1098951 0.78 HPGD (0.67) MEN1KMT2ANSD2MAPTTDP1
SCHEMBL15611159 0.78 CA12 (0.51) MEN1KMT2AMAPTCA12CA1
SCHEMBL15330418 0.77 KMT2A (0.58) MEN1KMT2AMAPTTDP1SMN1; SMN2
SCHEMBL7913602 0.77 MAPT (0.56) MEN1KMT2ANSD2MAPTTDP1
SCHEMBL7121986 0.77 MAPT (0.57) MEN1KMT2ANSD2MAPTCA12
SCHEMBL12649365 0.77 KMT2A (0.59) MEN1KMT2ANSD2MAPTCA12
SCHEMBL21465837 0.77 CA12 (0.58) MEN1KMT2ANSD2MAPTCA12
SCHEMBL10960406 0.77 NSD2 (0.70) MEN1KMT2ANSD2MAPTCA12

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-20110195195-A1 WATER-BORNE PAINTS BASED ON EPOXY RESINS CYTEC AUSTRIA GMBH (AT) 2011-08-11 US disclosed