SCHEMBL12832288

SCHEMBL12832288

CC/N=c1/ccc2c(-c3ccc(S(=O)(=O)O)cc3S(=O)(=O)O)c3ccc(N(CC)CC)cc3oc-2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.55
▸ KMT2A Q03164 4/20 0.55
▸ USP2 O75604 1/20 0.55
▸ POLB P06746 1/20 0.55
▸ PPARG P37231 1/20 0.55
▸ BLM P54132 1/20 0.55
▸ RXFP1 Q9HBX9 1/20 0.55
▸ NCOR2 Q9Y618 1/20 0.55
▸ CHRM1 P11229 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.38
▸ MAPT P10636 2/20 0.38
▸ CDC25A P30304 1/20 0.37
▸ CDC25C P30307 1/20 0.37
▸ SLC6A4 P31645 5/20 0.36
▸ GLA P06280 3/20 0.36
▸ SLC6A2 P23975 3/20 0.36
▸ SLC6A3 Q01959 3/20 0.36
▸ L3MBTL1 Q9Y468 3/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ HPGD P15428 2/20 0.36

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
SCHEMBL14693179 0.94 MEN1 (0.53) MEN1KMT2AUSP2POLBPPARG
SCHEMBL17814732 0.91 MEN1 (0.49) MEN1KMT2AUSP2POLBPPARG
SCHEMBL14338738 0.86 MEN1 (0.57) MEN1KMT2AUSP2POLBPPARG
SCHEMBL18465895 0.85 MEN1 (0.45) MEN1KMT2AUSP2POLBPPARG
SCHEMBL5712581 0.84 MEN1 (0.77) MEN1KMT2AUSP2POLBPPARG
Water SCHEMBL185914 0.83 MEN1 (0.76) MEN1KMT2AUSP2POLBPPARG
SCHEMBL29569925 0.83 MEN1 (0.79) MEN1KMT2AUSP2POLBPPARG
SCHEMBL17267894 0.83 MEN1 (0.76) MEN1KMT2AUSP2POLBPPARG
SCHEMBL17265451 0.83 MEN1 (0.66) MEN1KMT2AUSP2POLBPPARG
Water SCHEMBL7715723 0.82 MEN1 (0.75) MEN1KMT2AUSP2POLBPPARG

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2480610-B1 MIGRATION-FREE COLOURED COPOLYCONDENSATES FOR COLOURING POLYMERS BASF SE (DE) 2017-11-29 — — EP disclosed
WO-2011036075-A1 MIGRATION-FREE COLOURED COPOLYCONDENSATES FOR COLOURING POLYMERS BASF SE (DE) 2011-03-31 — — WO disclosed
WO-2009054829-A1 MAGENTA INKS AND INK SETS FOR INK-JET IMAGING HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2009-04-30 — — WO disclosed
Send feedback