SCHEMBL17146631

SCHEMBL17146631

O=S(=O)(O)c1cc2ccc(-c3cccc(-c4ccc5cc(S(=O)(=O)O)c6cccnc6c5n4)c3)nc2c2ncccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ COMT P21964 2/20 0.48
▸ CYP1A2 P05177 2/20 0.47
▸ HIF1A Q16665 2/20 0.47
▸ HPGD P15428 1/20 0.47
▸ ALOX15 P16050 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ PTPN11 Q06124 2/20 0.44
▸ PTPRC P08575 1/20 0.44
▸ PTPN1 P18031 1/20 0.44
▸ PTPN6 P29350 1/20 0.44
▸ PTPN7 P35236 1/20 0.44
▸ PTPRJ Q12913 1/20 0.44
▸ DUSP26 Q9BV47 1/20 0.44
▸ MEN1 O00255 1/20 0.39
▸ NSD2 O96028 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ IDE P14735 1/20 0.39
▸ DUSP3 P51452 1/20 0.39
▸ CCR6 P51684 1/20 0.39

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
SCHEMBL17146630 0.96 HIF1A (0.47) COMTCYP1A2HIF1AHPGDALOX15
SCHEMBL687000 0.82 COMT (0.59) COMTCYP1A2HIF1AHPGDALOX15
SCHEMBL17174183 0.81 NPC1 (0.36) COMTCYP1A2HIF1AHPGDALDH1A1
SCHEMBL17174165 0.80 KDM4E (0.44) COMTALOX15ALDH1A1MEN1KMT2A
SCHEMBL17146652 0.79 KDM4E (0.39) HIF1AHPGDALOX15ALDH1A1MEN1
SCHEMBL17146614 0.78 KDM4E (0.53) HIF1AALOX15ALDH1A1MEN1KMT2A
SCHEMBL17178165 0.78 KDM4E (0.52) ALDH1A1FTOKDM4EL3MBTL1LMNA
SCHEMBL17146632 0.77 HSP90AA1 (0.46) ALDH1A1MEN1KMT2AL3MBTL1MAPT
SCHEMBL17146667 0.77 L3MBTL1 (0.41) ALDH1A1MEN1POLBBLMKMT2A
SCHEMBL17146651 0.77 CCR1 (0.41) HIF1AALOX15ALDH1A1KDM4EL3MBTL1

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
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
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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