SCHEMBL17174188

SCHEMBL17174188

Nc1cc2ccc(-c3cccc(-c4ccc5ccc6ccc(-c7cccc(-c8ccc9cc(N)c%10cccnc%10c9n8)c7)nc6c5n4)c3)nc2c2ncccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 3/20 0.45
▸ HSP90AB1 P08238 2/20 0.45
▸ CCR1 P32246 3/20 0.40
▸ CCR8 P51685 3/20 0.40
▸ NR4A2 P43354 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ IDO1 P14902 1/20 0.40
▸ PSMB5 P28074 1/20 0.40
▸ LMNA P02545 3/20 0.38
▸ MAP4K4 O95819 5/20 0.38
▸ MAPT P10636 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ GMNN O75496 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ MMP2 P08253 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ MMP9 P14780 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ TSHR P16473 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
SCHEMBL17146632 0.99 HSP90AA1 (0.46) HSP90AA1HSP90AB1CCR1CCR8NR4A2
SCHEMBL19286484 0.97 CCR1 (0.44) HSP90AA1HSP90AB1CCR1CCR8NR4A2
SCHEMBL17146638 0.87 HSP90AA1 (0.43) HSP90AA1HSP90AB1CCR1CCR8NR4A2
SCHEMBL17146651 0.84 CCR1 (0.41) HSP90AA1CCR1CCR8L3MBTL1LMNA
SCHEMBL17174185 0.84 TDP1 (0.46) HSP90AA1CCR1CCR8L3MBTL1LMNA
SCHEMBL17174186 0.82 CCR1 (0.45) HSP90AA1CCR1CCR8L3MBTL1LMNA
SCHEMBL599744 0.81 CCR1 (0.59) HSP90AA1CCR1CCR8L3MBTL1LMNA
SCHEMBL17146611 0.81 CCR1 (0.59) HSP90AA1CCR1CCR8L3MBTL1LMNA
SCHEMBL17174191 0.81 CCR1 (0.59) HSP90AA1CCR1CCR8L3MBTL1LMNA
SCHEMBL29517679 0.81 CCR1 (0.59) HSP90AA1CCR1CCR8L3MBTL1LMNA

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 6 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-20170125832-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE WITH CATALYST LAYER, MEMBRANE ELECTRODE ASSEMBLY, AND POLYMER ELECTROLYTE FUEL CELL EACH USING THE SAME TORAY INDUSTRIES, INC. (JP) 2017-05-04 — — US disclosed
US-20170125832-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE WITH CATALYST LAYER, MEMBRANE ELECTRODE ASSEMBLY, AND POLYMER ELECTROLYTE FUEL CELL EACH USING THE SAME TORAY INDUSTRIES, INC. (JP) 2017-05-04 — — 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
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