SCHEMBL28718650

SCHEMBL28718650

O=C(O)c1csc2c(Cl)cc(Cl)nc12

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ EIF4EBP1 Q13541 3/20 0.35
▸ KEAP1 Q14145 1/20 0.35
▸ NFE2L2 Q16236 1/20 0.35
▸ GPR35 Q9HC97 2/20 0.35
▸ TSHR P16473 2/20 0.34
▸ DAO P14920 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ CASP1 P29466 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ PPARA Q07869 1/20 0.34
▸ EIF4E P06730 4/20 0.33
▸ AKR1C4 P17516 1/20 0.33
▸ AKR1C3 P42330 1/20 0.33
▸ AKR1C2 P52895 1/20 0.33
▸ AKR1C1 Q04828 1/20 0.33

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
SCHEMBL28704856 0.84 EIF4EBP1 (0.41) EIF4EBP1ALDH1A1SMN1; SMN2
SCHEMBL21814160 0.81 UGT8 (0.42) CASP1
SCHEMBL21813838 0.81 KDM4E (0.43) ALDH1A1SMN1; SMN2
SCHEMBL29560681 0.81 KDM4E (0.43) ALDH1A1SMN1; SMN2
SCHEMBL7208766 0.80 EIF4EBP1 (0.46) EIF4EBP1
SCHEMBL29214617 0.79 POLB (0.43) EIF4EBP1KEAP1NFE2L2GPR35ALDH1A1
SCHEMBL22346470 0.76 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL22866853 0.73 KDM5A (0.46) EIF4EBP1ALDH1A1SMN1; SMN2
SCHEMBL22346635 0.73 GPR35 (0.31) GPR35
SCHEMBL358314 0.72 KDM4E (0.37) SMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118239963-A Compounds as eIF4E inhibitors and uses thereof 南京圣和药业股份有限公司 2024-06-25 — — CN disclosed
CN-114269756-B 4-Oxo-3, 4-dihydropyrido [3,4-D ] pyrimidine compounds that inhibit EIF4E 效应疗法股份有限公司 2024-05-14 — — CN disclosed
CN-114269756-A 4-oxo-3, 4-dihydropyrido [3,4-D ] pyrimidine compounds inhibiting EIF4E 效应疗法股份有限公司 2022-04-01 — — CN disclosed
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