SCHEMBL27395079

SCHEMBL27395079

CC1(C)CCC(C)(C)c2cc(-c3ccccc3Nc3ccc4ccccc4c3)ccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 13/20 0.47
▸ RARG P13631 12/20 0.47
▸ RXRA P19793 3/20 0.47
▸ JAK2 O60674 1/20 0.42
▸ JAK3 P52333 1/20 0.42
▸ RARA P10276 13/20 0.42
▸ ALDH1A1 P00352 3/20 0.39
▸ CYP3A4 P08684 3/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ SLC6A2 P23975 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ CYP26A1 O43174 3/20 0.35
▸ CYP26B1 Q9NR63 1/20 0.35
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ MAPT P10636 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ CYP1A2 P05177 1/20 0.34

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
SCHEMBL27395175 0.87 RARB (0.51) RARBRARGRXRAJAK2JAK3
SCHEMBL26306683 0.82 CYP3A4 (0.53) RARBRARGJAK2JAK3RARA
SCHEMBL27395213 0.81 RARB (0.49) RARBRARGRXRAJAK2JAK3
SCHEMBL27395131 0.81 RARB (0.51) RARBRARGRXRAJAK2JAK3
SCHEMBL29893694 0.81 ALDH1A1 (0.53) ALDH1A1CYP3A4HPGDHSD17B10SLC6A2
SCHEMBL29104474 0.81 ALDH1A1 (0.53) ALDH1A1CYP3A4HPGDHSD17B10SLC6A2
SCHEMBL21615062 0.78 ALDH1A1 (0.41) JAK2ALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL27395223 0.78 RARB (0.50) RARBRARGRXRAJAK2JAK3
SCHEMBL9359619 0.78 RARB (0.63) RARBRARGRXRARARACYP26A1
SCHEMBL29336481 0.78 ALDH1A1 (0.44) ALDH1A1CYP3A4HPGDHSD17B10MEN1

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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