SCHEMBL17174170

SCHEMBL17174170

O=C(Oc1ccccc1)c1cc2ccc(-c3cccc(-c4ccc5ccc6cccnc6c5n4)c3)nc2c2ncccc12

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.57
▸ POLB P06746 1/20 0.49
▸ PARP1 P09874 1/20 0.41
▸ MAPT P10636 8/20 0.41
▸ LMNA P02545 1/20 0.40
▸ METAP2 P50579 1/20 0.40
▸ METAP1 P53582 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ CCR6 P51684 1/20 0.39
▸ TOP1 P11387 1/20 0.39
▸ TP53 P04637 4/20 0.38
▸ THRB P10828 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ TET2 Q6N021 1/20 0.37
▸ TET1 Q8NFU7 1/20 0.37

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
SCHEMBL17178120 0.97 ALDH1A1 (0.54) ALDH1A1POLBPARP1MAPTLMNA
SCHEMBL17174174 0.94 ALDH1A1 (0.49) ALDH1A1POLBMAPTKDM4ETDP1
SCHEMBL17174202 0.86 ALDH1A1 (0.56) ALDH1A1POLBPARP1MAPTLMNA
SCHEMBL17174167 0.86 KDM4E (0.49) ALDH1A1PARP1LMNAKDM4ETET2
SCHEMBL17174204 0.83 ALDH1A1 (0.55) ALDH1A1PARP1MAPTLMNAMETAP2
SCHEMBL17178165 0.82 KDM4E (0.52) ALDH1A1LMNAKDM4ETET2TET1
SCHEMBL17174179 0.79 TOP1 (0.45) ALDH1A1MAPTLMNAKDM4ETDP1
SCHEMBL17174163 0.78 MMP2 (0.45) ALDH1A1MAPTLMNAMETAP2METAP1
SCHEMBL17146657 0.77 MAPT (0.56) ALDH1A1POLBPARP1MAPTLMNA
SCHEMBL17178182 0.75 TOP1 (0.44) ALDH1A1POLBMAPTTOP1NPSR1

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 4 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
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