SCHEMBL16002467

SCHEMBL16002467

c1ccc(-c2nc3cc(-c4c5ccccc5c(-c5ccc6ccccc6c5)c5ccccc45)ccc3[nH]2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 9/20 0.51
▸ RAB9A P51151 9/20 0.51
▸ GAA P10253 3/20 0.51
▸ KDM4E B2RXH2 8/20 0.46
▸ ALDH1A1 P00352 8/20 0.46
▸ SMN1; SMN2 Q16637 8/20 0.46
▸ HPGD P15428 7/20 0.46
▸ MAPT P10636 5/20 0.46
▸ PRMT1 Q99873 1/20 0.46
▸ STAT1 P42224 1/20 0.46
▸ CHEK2 O96017 2/20 0.45
▸ PDE10A Q9Y233 1/20 0.45
▸ TP53 P04637 4/20 0.45
▸ HSD17B10 Q99714 4/20 0.45
▸ TSHR P16473 2/20 0.45
▸ NFKB1 P19838 2/20 0.45
▸ NFKB2 Q00653 2/20 0.45
▸ RELA Q04206 2/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44

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
SCHEMBL27825168 0.85 PRMT1 (0.54) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL17755354 0.85 NPC1 (0.55) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL14459963 0.84 NPC1 (0.53) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL14459921 0.83 NPC1 (0.51) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL14459692 0.83 NPC1 (0.54) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL21769798 0.83 NPC1 (0.48) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL30293222 0.83 NPC1 (0.51) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL16994454 0.83 NPC1 (0.51) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL14459924 0.82 NPC1 (0.53) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL28793724 0.81 PRMT1 (0.52) NPC1RAB9AGAAKDM4EALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140246663-A1 ORGANIC ELECTROLUMINESCENT ELEMENT JDI DESIGN AND DEVELOPMENT G.K. (JP) 2014-09-04 — — US disclosed
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