SCHEMBL23439362

SCHEMBL23439362

Cc1ccccc1Nc1ccc2c(c1)oc1cc3c(cc12)C(C)(C)CCC3(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.40
▸ LMNA P02545 3/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ SMN1; SMN2 Q16637 5/20 0.38
▸ GAA P10253 6/20 0.36
▸ MAPT P10636 3/20 0.36
▸ HPGD P15428 3/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ MAPK13 O15264 1/20 0.35
▸ MAPK12 P53778 1/20 0.35
▸ MAPK11 Q15759 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ RAB9A P51151 5/20 0.34
▸ NPC1 O15118 4/20 0.34
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ DUSP3 P51452 1/20 0.34
▸ HTT P42858 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ TP53 P04637 1/20 0.33

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
SCHEMBL31069424 0.93 ALDH1A1 (0.40) ALDH1A1LMNAL3MBTL1SMN1; SMN2GAA
SCHEMBL23438794 0.88 ALDH1A1 (0.36) ALDH1A1LMNAL3MBTL1SMN1; SMN2GAA
SCHEMBL23438805 0.85 RARB (0.36) ALDH1A1LMNAL3MBTL1SMN1; SMN2GAA
SCHEMBL31069417 0.85 RARB (0.36) ALDH1A1LMNAL3MBTL1SMN1; SMN2GAA
SCHEMBL23439921 0.85 DUSP3 (0.41) ALDH1A1LMNASMN1; SMN2GAAMAPT
SCHEMBL23421687 0.83 SMN1; SMN2 (0.41) ALDH1A1LMNAL3MBTL1SMN1; SMN2GAA
SCHEMBL19087508 0.80 SMN1; SMN2 (0.56) ALDH1A1LMNAL3MBTL1SMN1; SMN2GAA
SCHEMBL23439428 0.80 RXRA (0.34) ALDH1A1LMNAL3MBTL1MEN1KMT2A
SCHEMBL24562625 0.78 ALDH1A1 (0.38) ALDH1A1LMNASMN1; SMN2GAAMAPT
SCHEMBL23421632 0.77 KMT2A (0.45) ALDH1A1LMNAL3MBTL1SMN1; SMN2GAA

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
CN-113924307-B Polycyclic compound and organic light-emitting element including the same 株式会社LG化学 2024-08-20 — — CN disclosed
WO-2021107711-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2021-06-03 — — WO disclosed
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