SCHEMBL17174202

SCHEMBL17174202

O=C(Oc1ccccc1)c1cc(-c2ccc3ccc4cccnc4c3n2)cc(-c2ccc3ccc4ccc(-c5cccc(-c6ccc7ccc8cccnc8c7n6)c5)nc4c3n2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.56
▸ LMNA P02545 1/20 0.50
▸ METAP2 P50579 1/20 0.50
▸ METAP1 P53582 1/20 0.50
▸ HDAC6 Q9UBN7 1/20 0.50
▸ MAPT P10636 5/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ PARP1 P09874 1/20 0.42
▸ TOP1 P11387 1/20 0.42
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ NSD2 O96028 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ PDE4A P27815 3/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40

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
SCHEMBL17174204 0.98 ALDH1A1 (0.55) ALDH1A1LMNAMETAP2METAP1HDAC6
SCHEMBL17174101 0.87 MAPT (0.57) ALDH1A1LMNAMAPTTDP1PARP1
SCHEMBL17146657 0.86 MAPT (0.56) ALDH1A1LMNAMETAP2METAP1HDAC6
SCHEMBL17174170 0.86 ALDH1A1 (0.57) ALDH1A1LMNAMETAP2METAP1HDAC6
SCHEMBL17174091 0.85 MAPT (0.46) ALDH1A1MAPTTDP1PARP1KMT2A
SCHEMBL17174100 0.84 MAPT (0.50) ALDH1A1MAPTTDP1PARP1KMT2A
SCHEMBL17174123 0.84 MAPT (0.50) ALDH1A1MAPTTDP1PARP1KMT2A
SCHEMBL17146659 0.84 MAPT (0.46) ALDH1A1MAPTTDP1PARP1KMT2A
SCHEMBL17174102 0.84 MAPT (0.60) ALDH1A1LMNAMAPTTDP1PARP1
SCHEMBL17174193 0.84 PDE4A (0.49) ALDH1A1LMNAMAPTTDP1PARP1

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
Send feedback