SCHEMBL27395281

SCHEMBL27395281

CC1(C)CCC(C)(C)c2c(-c3cccc(Nc4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)c3)cccc21

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 3/20 0.40
▸ JAK2 O60674 1/20 0.36
▸ JAK3 P52333 1/20 0.36
▸ RARB P10826 1/20 0.33
▸ RARG P13631 1/20 0.33
▸ RXRA P19793 1/20 0.33
▸ GRM5 P41594 1/20 0.31
▸ BRD4 O60885 1/20 0.30
▸ CNR1 P21554 1/20 0.30

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 0.86 RARB (0.45) PDK2JAK2JAK3RARBRARG
SCHEMBL27395220 0.81 RARB (0.47) JAK2JAK3RARBRARGRXRA
SCHEMBL29518615 0.80 PDK2 (0.51) PDK2BRD4CNR1
SCHEMBL17886978 0.80 PDK2 (0.51) PDK2BRD4CNR1
SCHEMBL27394930 0.80 ALDH1A1 (0.41) PDK2JAK2JAK3RARBRARG
SCHEMBL27394990 0.80 RARB (0.42) PDK2JAK2JAK3RARBRARG
SCHEMBL27394921 0.78 RARB (0.33) JAK2JAK3RARBRARGRXRA
SCHEMBL2468177 0.78 CNR1 (0.48) PDK2CNR1
SCHEMBL22182457 0.77 PDK2 (0.41) PDK2
SCHEMBL26952619 0.77 RARB (0.34) PDK2JAK2JAK3RARBRARG

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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