SCHEMBL17146660

SCHEMBL17146660

O=S(=O)(O)Oc1ccc(-c2ccc3ccc4ccc(-c5cc(OS(=O)(=O)O)cc(-c6ccc7ccc8ccc(-c9ccccc9)nc8c7n6)c5)nc4c3n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 2/20 0.41
▸ GLA P06280 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ CA2 P00918 5/20 0.39
▸ CA1 P00915 3/20 0.39
▸ CA9 Q16790 3/20 0.39
▸ CA12 O43570 4/20 0.36
▸ MCL1 Q07820 1/20 0.36
▸ CYP11B1 P15538 1/20 0.35
▸ CYP11B2 P19099 1/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ NFKB2 Q00653 1/20 0.35
▸ RELA Q04206 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ F11 P03951 1/20 0.34
▸ PTGS2 P35354 1/20 0.34

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
SCHEMBL19287852 0.95 GLA (0.42) PARP1GLAGAANPC1RAB9A
SCHEMBL19287892 0.93 PARP1 (0.45) PARP1GLAGAACA2CA1
SCHEMBL17146624 0.86 GLA (0.38) PARP1GLAGAACA2CA1
SCHEMBL17174138 0.86 MAPT (0.41) PARP1GLAGAACYP11B1CYP11B2
SCHEMBL17174131 0.84 CISD1 (0.43) PARP1GLAGAACYP11B1CYP11B2
SCHEMBL17174141 0.83 GLA (0.39) PARP1GLAGAACA2CA1
SCHEMBL19287854 0.82 KDM4E (0.44) CA2CA1CA9KDM4EALDH1A1
SCHEMBL19287828 0.81 KDM4E (0.43) CA2CA1CA9KDM4EALDH1A1
SCHEMBL17174218 0.78 KDM4E (0.42) GAAKDM4EALDH1A1NFKB1SMN1; SMN2
SCHEMBL17174117 0.77 MCL1 (0.47) PARP1GLAMCL1CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9748593-B2 Polymer electrolyte composition, and polymer electrolyte membrane, membrane electrode complex and solid polymer-type fuel cell each produced using same TORAY INDUSTRIES, INC. (JP) 2017-08-29 — — US disclosed
US-9748593-B2 Polymer electrolyte composition, and polymer electrolyte membrane, membrane electrode complex and solid polymer-type fuel cell each produced using same TORAY INDUSTRIES, INC. (JP) 2017-08-29 — — US disclosed
US-20150295262-A1 POLYMER ELECTROLYTE COMPOSITION, AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE ELECTRODE COMPLEX AND SOLID POLYMER-TYPE FUEL CELL EACH PRODUCED USING SAME TORAY INDUSTRIES, INC. (JP) 2015-10-15 — — US disclosed
US-20150295262-A1 POLYMER ELECTROLYTE COMPOSITION, AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE ELECTRODE COMPLEX AND SOLID POLYMER-TYPE FUEL CELL EACH PRODUCED USING SAME TORAY INDUSTRIES, INC. (JP) 2015-10-15 — — US disclosed
EP-2927283-A1 POLYMER ELECTROLYTE COMPOSITION, AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE ELECTRODE COMPLEX AND SOLID POLYMER-TYPE FUEL CELL EACH PRODUCED USING SAME Toray Industries, Inc. (JP) 2015-10-07 — — EP disclosed
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