SCHEMBL17178166

SCHEMBL17178166

O=[PH](O)Oc1cc2ccc(-c3cccc(-c4ccc5cc(OP(O)O)c6cccnc6c5n4)c3)nc2c2ncccc12

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.33
▸ CCR1 P32246 2/20 0.30
▸ CCR8 P51685 2/20 0.30
▸ L3MBTL1 Q9Y468 2/20 0.30
▸ TOP1 P11387 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30

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
SCHEMBL17146627 0.89 CCR1 (0.38) NPC1CCR1CCR8L3MBTL1TOP1
SCHEMBL17178179 0.83 NPC1 (0.35) NPC1CCR1CCR8L3MBTL1TOP1
SCHEMBL17178180 0.80 CCR1 (0.36) NPC1CCR1CCR8L3MBTL1TOP1
SCHEMBL17178137 0.77 LMNA (0.37) NPC1CCR1CCR8L3MBTL1ALDH1A1
SCHEMBL17174182 0.76 NPC1 (0.36) NPC1CCR1CCR8L3MBTL1TOP1
SCHEMBL17174183 0.76 NPC1 (0.36) NPC1CCR1CCR8L3MBTL1TOP1
SCHEMBL17146609 0.74 LMNA (0.39) CCR1CCR8TOP1ALDH1A1MAPT
SCHEMBL17178144 0.74 MAP4K4 (0.34) —
SCHEMBL17146652 0.73 KDM4E (0.39) NPC1CCR1CCR8L3MBTL1ALDH1A1
SCHEMBL17146647 0.73 SRC (0.39) NPC1CCR1CCR8L3MBTL1TOP1

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 2 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
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