SCHEMBL27395221

SCHEMBL27395221

CC1(C)CCC(C)(C)c2cc(-c3cccc(Nc4ccccc4-c4cccc5c4C(C)(C)CCC5(C)C)c3)ccc21

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 10/20 0.43
▸ RARA P10276 10/20 0.43
▸ RARG P13631 9/20 0.43
▸ RXRA P19793 3/20 0.43
▸ JAK2 O60674 1/20 0.39
▸ JAK3 P52333 1/20 0.39
▸ SIRT2 Q8IXJ6 1/20 0.34
▸ SIRT1 Q96EB6 1/20 0.34
▸ HNF4A P41235 1/20 0.34
▸ TP53 P04637 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ AKR1C3 P42330 3/20 0.32
▸ STK10 O94804 1/20 0.32
▸ SLK Q9H2G2 1/20 0.32
▸ PGR P06401 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
SCHEMBL27395131 0.89 RARB (0.51) RARBRARARARGRXRAJAK2
SCHEMBL27395182 0.89 RARA (0.48) RARBRARARARGRXRAJAK2
SCHEMBL27395213 0.84 RARB (0.49) RARBRARARARGRXRAJAK2
SCHEMBL27395220 0.84 RARB (0.47) RARBRARARARGRXRAJAK2
SCHEMBL27395162 0.84 RARB (0.38) RARBRARARARGRXRAJAK2
SCHEMBL27395223 0.81 RARB (0.50) RARBRARARARGRXRAJAK2
SCHEMBL26306083 0.81 RARA (0.56) RARBRARARARGRXRAHNF4A
SCHEMBL27395077 0.81 FADS1 (0.48) RARBRARARARGRXRAJAK2
SCHEMBL27395175 0.80 RARB (0.51) RARBRARARARGRXRAJAK2
SCHEMBL27395186 0.79 RARA (0.54) RARBRARARARGRXRAJAK2

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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