SCHEMBL18422237

SCHEMBL18422237

COc1cccc(-c2ccc3c(N)cc4cccnc4c3n2)c1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ NSD2 O96028 1/20 0.41
▸ CASP6 P55212 1/20 0.41
▸ G6PD P11413 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ TLR8 Q9NR97 1/20 0.41
▸ PDE10A Q9Y233 1/20 0.40
▸ SYK P43405 1/20 0.39
▸ DYRK1A Q13627 2/20 0.39
▸ NFATC1 O95644 1/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ MGAM O43451 1/20 0.39
▸ GAA P10253 1/20 0.39

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
SCHEMBL17146638 0.76 HSP90AA1 (0.43) NPC1RAB9ASMN1; SMN2LMNATP53
SCHEMBL11372869 0.74 MGAM (0.43) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL11380646 0.72 SYK (0.58) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL28508238 0.72 DYRK1A (0.60) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL30507427 0.72 DYRK1A (0.60) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL30833380 0.71 CCR1 (0.51) NPC1SMN1; SMN2LMNACASP6ALDH1A1
SCHEMBL29155843 0.71 CCR1 (0.51) NPC1SMN1; SMN2LMNACASP6ALDH1A1
SCHEMBL139256 0.70 CCR1 (0.61) NPC1MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL1672334 0.70 PDE10A (0.57) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL28410071 0.70 MGAM (0.49) NPC1RAB9AMEN1KMT2ASMN1; SMN2

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-10186725-B2 Polymer electrolyte composition and polymer electrolyte membrane, polymer electrolyte membrane with catalyst layer, membrane electrode assembly, and polymer electrolyte fuel cell each using the same TORAY INDUSTRIES, INC. (JP) 2019-01-22 — — US disclosed
US-20170033387-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE WITH CATALYST LAYER, MEMBRANE ELECTRODE ASSEMBLY, AND POLYMER ELECTROLYTE FUEL CELL EACH USING THE SAME CELLCENTRIC GMBH & CO. KG (DE) 2017-02-02 — — US disclosed
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