SCHEMBL24779265

SCHEMBL24779265

Cc1cc2c(c(C)c1Nc1coc3ccc(C(C)(C)C)cc13)OCCO2

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 1/20 0.33
▸ ADRA2A P08913 2/20 0.31
▸ ADRA2C P18825 2/20 0.31
▸ ADRA1D P25100 2/20 0.31
▸ ADRA1A P35348 2/20 0.31
▸ ADRA1B P35368 2/20 0.31
▸ ADRA2B P18089 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
SCHEMBL24779288 0.82 RAPGEF4 (0.37) —
SCHEMBL24778835 0.81 TRPV1 (0.40) TRPV1
SCHEMBL24778558 0.79 KDM4E (0.34) TRPV1ADRA2AADRA2CADRA1DADRA1A
SCHEMBL29911045 0.76 CSNK1D (0.37) —
SCHEMBL23447235 0.76 CSNK1D (0.37) —
SCHEMBL30872231 0.72 AKR1C3 (0.40) —
SCHEMBL23450954 0.72 AKR1C3 (0.40) —
SCHEMBL24779279 0.72 — —
SCHEMBL24509571 0.69 AKR1C3 (0.37) —
SCHEMBL30679833 0.68 CSNK1D (0.41) —

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-2022255634-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2022-12-08 — — WO disclosed
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