SCHEMBL27343841

SCHEMBL27343841

CC1(C)OB(c2cc3ccc4ccc5ccccc5c4c3cn2)OC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 2/20 0.40
▸ LIPG Q9Y5X9 2/20 0.40
▸ AHR P35869 2/20 0.34
▸ ERBB2 P04626 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ FYN P06241 1/20 0.34
▸ MAOA P21397 1/20 0.34
▸ ACHE P22303 1/20 0.34
▸ IRAK4 Q9NWZ3 1/20 0.34
▸ ALPL P05186 1/20 0.33
▸ HIF1A Q16665 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ CYP1B1 Q16678 1/20 0.33
▸ NQO2 P16083 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 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
SCHEMBL27343624 0.89 LPL (0.40) LPLLIPGAHRERBB2CYP1A2
SCHEMBL15400071 0.79 LPL (0.47) LPLLIPGCYP1A2IRAK4ALPL
SCHEMBL12451902 0.77 LPL (0.54) LPLLIPGAHRERBB2CYP1A2
SCHEMBL27344557 0.76 LPL (0.44) LPLLIPGIRAK4ALPLRAB9A
SCHEMBL27343080 0.76 LPL (0.39) LPLLIPGAHRERBB2CYP1A2
SCHEMBL23753688 0.76 LPL (0.55) LPLLIPGAHRERBB2CYP1A2
SCHEMBL30565011 0.76 LPL (0.55) LPLLIPGAHRERBB2CYP1A2
SCHEMBL27343476 0.75 LPL (0.45) LPLLIPGIRAK4ALPL
SCHEMBL24473145 0.74 LPL (0.50) LPLLIPGAHRERBB2CYP1A2
SCHEMBL20176456 0.74 LPL (0.44) LPLLIPGAHRERBB2CYP1A2

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
WO-2024005486-A1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2024-01-04 — — WO disclosed
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