SCHEMBL27395162

SCHEMBL27395162

CC1(C)CCC(C)(C)c2c(-c3ccccc3Nc3cc(-c4ccccc4)cc(-c4ccccc4)c3)cccc21

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 3/20 0.38
▸ RARG P13631 3/20 0.38
▸ RARA P10276 2/20 0.38
▸ RXRA P19793 1/20 0.34
▸ SIRT2 Q8IXJ6 1/20 0.34
▸ SIRT1 Q96EB6 1/20 0.34
▸ TP53 P04637 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ PTGS1 P23219 1/20 0.32
▸ PTGS2 P35354 1/20 0.32
▸ AKR1C3 P42330 1/20 0.31
▸ JAK2 O60674 1/20 0.31
▸ JAK3 P52333 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
SCHEMBL27395221 0.84 RARB (0.43) RARBRARGRARARXRASIRT2
SCHEMBL25491148 0.78 RARB (0.40) RARBRARGRARARXRASIRT2
SCHEMBL31375644 0.78 RARB (0.40) RARBRARGRARARXRASIRT2
SCHEMBL27395156 0.77 RARB (0.45) RARBRARGRARARXRASIRT2
SCHEMBL26951879 0.76 RARB (0.34) RARBRARGRARARXRAJAK2
SCHEMBL26952619 0.76 RARB (0.34) RARBRARGRARARXRAJAK2
SCHEMBL27395112 0.76 HDAC4 (0.37) RARBRARGRARARXRATP53
SCHEMBL23421819 0.75 RARB (0.45) RARBRARGRARARXRATP53
SCHEMBL27395020 0.75 RARB (0.41) RARBRARGRARARXRA
SCHEMBL27395213 0.75 RARB (0.49) RARBRARGRARARXRATP53

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-2024096578-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE HAVING SAME 덕산네오룩스 주식회사 2024-05-10 — — WO disclosed
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