SCHEMBL27394990

SCHEMBL27394990

CC1(C)CCC(C)(C)c2c(-c3ccc(Nc4ccc(-c5ccccc5)c(-c5ccccc5)c4)cc3)cccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 4/20 0.42
▸ RARG P13631 3/20 0.42
▸ RXRA P19793 2/20 0.42
▸ PDK2 Q15119 1/20 0.39
▸ JAK2 O60674 1/20 0.37
▸ JAK3 P52333 1/20 0.37
▸ APP P05067 1/20 0.36
▸ RARA P10276 3/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ AR P10275 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.33
▸ PTPN1 P18031 1/20 0.33
▸ CDC25A P30304 1/20 0.33
▸ CDC25B P30305 1/20 0.33
▸ PTGS2 P35354 3/20 0.33
▸ MAPK14 Q16539 2/20 0.32
▸ RXRB P28702 1/20 0.32

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
SCHEMBL27395156 0.88 RARB (0.45) RARBRARGRXRAPDK2JAK2
SCHEMBL23421819 0.82 RARB (0.45) RARBRARGRXRARARAALDH1A1
SCHEMBL27395220 0.80 RARB (0.47) RARBRARGRXRAJAK2JAK3
SCHEMBL27395281 0.80 PDK2 (0.40) RARBRARGRXRAPDK2JAK2
SCHEMBL27394930 0.80 ALDH1A1 (0.41) RARBRARGRXRAPDK2JAK2
SCHEMBL27395453 0.80 STK10 (0.36) RARBRARGRXRAPDK2RARA
SCHEMBL27287437 0.78 ALDH1A1 (0.48) PDK2APPMEN1ALDH1A1AR
SCHEMBL27395213 0.78 RARB (0.49) RARBRARGRXRAJAK2JAK3
SCHEMBL31245655 0.76 PDK2 (0.40) RARBRARGRXRAPDK2APP
SCHEMBL24969174 0.76 PDK2 (0.42) RARBRARGRXRAPDK2APP

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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