SCHEMBL27395156

SCHEMBL27395156

CC1(C)CCC(C)(C)c2c(-c3cccc(Nc4cccc(-c5ccccc5-c5ccccc5)c4)c3)cccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 4/20 0.45
▸ RARG P13631 4/20 0.45
▸ RXRA P19793 1/20 0.45
▸ MEN1 O00255 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ AR P10275 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.36
▸ PDK2 Q15119 1/20 0.35
▸ RARA P10276 3/20 0.35
▸ JAK2 O60674 1/20 0.34
▸ JAK3 P52333 1/20 0.34
▸ SIRT2 Q8IXJ6 1/20 0.33
▸ SIRT1 Q96EB6 1/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ HNF4A P41235 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CLK4 Q9HAZ1 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
SCHEMBL27394990 0.88 RARB (0.42) RARBRARGRXRAMEN1MAPT
SCHEMBL27395281 0.86 PDK2 (0.40) RARBRARGRXRAPDK2JAK2
SCHEMBL23421819 0.85 RARB (0.45) RARBRARGRXRAALDH1A1RARA
SCHEMBL27395220 0.83 RARB (0.47) RARBRARGRXRAMEN1KMT2A
SCHEMBL27394930 0.83 ALDH1A1 (0.41) RARBRARGRXRAMAPTALDH1A1
SCHEMBL27394921 0.79 RARB (0.33) RARBRARGRXRARARAJAK2
SCHEMBL24370053 0.78 ALDH1A1 (0.58) MEN1MAPTKMT2AALDH1A1AR
SCHEMBL27395162 0.77 RARB (0.38) RARBRARGRXRARARAJAK2
SCHEMBL27395221 0.77 RARB (0.43) RARBRARGRXRARARAJAK2
SCHEMBL16749674 0.77 MAPT (0.62) MEN1MAPTKMT2AALDH1A1AR

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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