SCHEMBL8619998

SCHEMBL8619998

O=C1c2ccccc2C(O)N1CCCOc1ccccn1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ SCN9A Q15858 3/20 0.48
▸ KCNH2 Q12809 2/20 0.48
▸ SCN5A Q14524 2/20 0.48
▸ HPGD P15428 3/20 0.45
▸ LMNA P02545 1/20 0.45
▸ PKM P14618 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ TSHR P16473 2/20 0.40
▸ NPC1 O15118 3/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ TP53 P04637 2/20 0.40
▸ TOP1 P11387 1/20 0.39
▸ STAT3 P40763 1/20 0.38
▸ STAT1 P42224 1/20 0.38

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
SCHEMBL8793929 0.82 L3MBTL1 (0.49) L3MBTL1SCN9AKCNH2SCN5AHPGD
SCHEMBL12522822 0.78 L3MBTL1 (0.52) L3MBTL1HPGDLMNAPKMALDH1A1
SCHEMBL8619461 0.77 L3MBTL1 (0.46) L3MBTL1SCN9AKCNH2SCN5AHPGD
SCHEMBL23585046 0.77 L3MBTL1 (0.59) L3MBTL1HPGDLMNAPKMALDH1A1
SCHEMBL9185538 0.76 L3MBTL1 (0.50) L3MBTL1HPGDLMNAPKMALDH1A1
SCHEMBL9188610 0.76 L3MBTL1 (0.56) L3MBTL1HPGDLMNAPKMALDH1A1
SCHEMBL12939880 0.76 L3MBTL1 (0.58) L3MBTL1HPGDLMNAPKMALDH1A1
SCHEMBL7212283 0.76 RAB9A (0.62) L3MBTL1PKMALDH1A1RAB9ASMN1; SMN2
SCHEMBL9188543 0.76 L3MBTL1 (0.58) L3MBTL1HPGDLMNAPKMALDH1A1
SCHEMBL27960801 0.76 L3MBTL1 (0.58) L3MBTL1HPGDLMNAPKMALDH1A1

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-5767121-A ANTIINFLAMMATORY AND -ARTHRITIC AGENTS; ANTIPYRETICS; ANALGESICS; ADHESION PROTEIN EXPRESSION AND CYCLOXYGENASE AND 5-LIPOXYGENASE INHIBITORS; IMMUNOSUPPRESSANTS AND -MODULATORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-06-16 — — US disclosed
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