SCHEMBL26952029

SCHEMBL26952029

CC1(C)CCC(C)(C)c2cc(-c3cc4c(cc3Nc3ccccc3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)ccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 15/20 0.45
▸ RARG P13631 14/20 0.45
▸ RXRA P19793 3/20 0.45
▸ RARA P10276 14/20 0.36
▸ HNF4A P41235 1/20 0.34
▸ MEN1 O00255 4/20 0.33
▸ KMT2A Q03164 4/20 0.33
▸ JAK2 O60674 1/20 0.33
▸ JAK3 P52333 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ CYP26A1 O43174 2/20 0.31
▸ CYP3A4 P08684 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ TSHR P16473 1/20 0.31

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
SCHEMBL26952137 0.96 RARB (0.43) RARBRARGRXRARARAHNF4A
SCHEMBL26952491 0.94 RARB (0.47) RARBRARGRXRARARAHNF4A
SCHEMBL26952554 0.90 RARB (0.46) RARBRARGRXRARARAHNF4A
SCHEMBL26951637 0.88 RARB (0.47) RARBRARGRXRARARAHNF4A
SCHEMBL26951736 0.83 RARB (0.46) RARBRARGRXRARARAHNF4A
SCHEMBL26951708 0.83 RARB (0.46) RARBRARGRXRARARAHNF4A
SCHEMBL26952248 0.83 RARB (0.32) RARBRARGRXRARARAMEN1
SCHEMBL30612827 0.82 MEN1 (0.42) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL30714376 0.82 RARB (0.48) RARBRARGRXRARARAMEN1
SCHEMBL26922591 0.82 RARB (0.48) RARBRARGRXRARARAMEN1

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-2023239091-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2023-12-14 — — WO disclosed
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