SCHEMBL17178165

SCHEMBL17178165

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.52
▸ LMNA P02545 2/20 0.52
▸ HTT P42858 1/20 0.52
▸ AURKA O14965 1/20 0.48
▸ PDE10A Q9Y233 2/20 0.47
▸ KDM4A O75164 2/20 0.47
▸ EGLN1 Q9GZT9 2/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ TET2 Q6N021 2/20 0.47
▸ TET1 Q8NFU7 2/20 0.47
▸ KDM6B O15054 1/20 0.47
▸ KDM6A O15550 1/20 0.47
▸ TET3 O43151 1/20 0.47
▸ KDM4B O94953 1/20 0.47
▸ KDM5C P41229 1/20 0.47
▸ KDM4D Q6B0I6 1/20 0.47
▸ ALKBH5 Q6P6C2 1/20 0.47
▸ FTO Q9C0B1 1/20 0.47
▸ KDM4C Q9H3R0 1/20 0.47
▸ KDM2A Q9Y2K7 1/20 0.47

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
SCHEMBL17174167 0.96 KDM4E (0.49) KDM4ELMNAHTTAURKAPDE10A
SCHEMBL17174169 0.88 PDE10A (0.43) KDM4ELMNAHTTAURKAPDE10A
SCHEMBL17178120 0.85 ALDH1A1 (0.54) KDM4ELMNAHTTPDE10AL3MBTL1
SCHEMBL17174170 0.82 ALDH1A1 (0.57) KDM4ELMNATET2TET1ALDH1A1
SCHEMBL679992 0.81 KDM4E (0.60) KDM4ELMNAHTTKDM4AEGLN1
SCHEMBL8674711 0.81 KDM4E (0.54) KDM4ELMNAHTTKDM4AEGLN1
SCHEMBL17174165 0.81 KDM4E (0.44) KDM4ELMNAHTTL3MBTL1FTO
SCHEMBL17174174 0.80 ALDH1A1 (0.49) KDM4EPDE10AL3MBTL1ALDH1A1
SCHEMBL17174193 0.78 PDE4A (0.49) KDM4ELMNAHTTSMN1; SMN2ALDH1A1
SCHEMBL17146631 0.78 COMT (0.48) KDM4ELMNAHTTL3MBTL1FTO

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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