SCHEMBL31273240

SCHEMBL31273240

CC(C)c1cc2[nH]c(=O)c(C(=O)Oc3c(F)c(F)c(F)c(F)c3F)cc2cc1F

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ EIF4A3 P38919 4/20 0.52
▸ ALDH1A1 P00352 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ DYRK1A Q13627 1/20 0.31
▸ DYRK1B Q9Y463 1/20 0.31
▸ DAO P14920 2/20 0.31
▸ DDO Q99489 1/20 0.31
▸ CNR2 P34972 1/20 0.30
▸ IKBKE Q14164 1/20 0.30
▸ TBK1 Q9UHD2 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ PTGS1 P23219 1/20 0.30
▸ PTGS2 P35354 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
SCHEMBL31273874 0.86 EIF4A3 (0.56) EIF4A3ALDH1A1KDM4EPOLBGAA
SCHEMBL31273247 0.82 EIF4A3 (0.68) EIF4A3ALDH1A1KDM4EPOLBGAA
SCHEMBL31273285 0.81 EIF4A3 (0.48) EIF4A3ALDH1A1KDM4EPOLBGAA
SCHEMBL31423009 0.81 GRIA1 (0.37) ALDH1A1KDM4EPOLBGAA
SCHEMBL31273200 0.76 DAO (0.55) ALDH1A1KDM4EDAODDO
SCHEMBL31422833 0.76 KDM4E (0.32) ALDH1A1KDM4EPOLBGAA
SCHEMBL31273602 0.73 DAO (0.39) ALDH1A1KDM4EPOLBGAADAO
SCHEMBL31273400 0.73 DAO (0.39) ALDH1A1KDM4EPOLBGAADAO
SCHEMBL31272756 0.72 DAO (0.38) ALDH1A1KDM4EPOLBGAADAO
SCHEMBL31423379 0.72 KDM4E (0.39) ALDH1A1KDM4EPOLBGAADAO

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
CN-119101045-A Nitrogen-containing heterocyclic compounds, and preparation method and application thereof 上海宇道生物技术有限公司 2024-12-10 — — CN disclosed
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