SCHEMBL29294357

SCHEMBL29294357

OB(O)c1ccc(N(c2ccc3oc4ccccc4c3c2)c2ccccc2-c2ccccc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 2/20 0.36
▸ CA1 P00915 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ NPC1 O15118 3/20 0.35
▸ HPGD P15428 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.33
▸ HSP90AB1 P08238 1/20 0.33
▸ BCAT1 P54687 1/20 0.33
▸ AHR P35869 1/20 0.33
▸ ALOX5 P09917 2/20 0.32
▸ NPY5R Q15761 1/20 0.32
▸ KEAP1 Q14145 1/20 0.31

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
SCHEMBL25608187 0.89 NPC1 (0.40) CA1CA2NPC1HPGDRAB9A
SCHEMBL18212070 0.87 NPC1 (0.41) CA1CA2NPC1HPGDRAB9A
SCHEMBL18212124 0.86 PLA2G2A (0.42) NPC1HPGDRAB9ASMN1; SMN2KDM4E
SCHEMBL17083563 0.86 MAPT (0.40) CA1CA2NPC1HPGDRAB9A
SCHEMBL27111889 0.85 AHR (0.43) CA1CA2NPC1HPGDRAB9A
SCHEMBL31195961 0.85 AHR (0.43) CA1CA2NPC1HPGDRAB9A
SCHEMBL17285617 0.85 HPGD (0.39) CA1CA2NPC1HPGDRAB9A
SCHEMBL22259437 0.85 NPC1 (0.41) CA1CA2NPC1HPGDRAB9A
SCHEMBL27101539 0.85 MAPT (0.42) MGLLCA1CA2NPC1HPGD
SCHEMBL19598814 0.84 PLA2G2A (0.44) CA1CA2NPC1HPGDRAB9A

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-20240237518-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2024-07-11 — — US disclosed
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