SCHEMBL29561004

SCHEMBL29561004

COCc1cc(Br)c2scc(C(=O)OC(C)(C)C)c2n1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTPRB P23467 1/20 0.33
▸ KDM4E B2RXH2 3/20 0.32
▸ UGT8 Q16880 1/20 0.30
▸ EGFR P00533 1/20 0.30
▸ MTNR1A P48039 1/20 0.30
▸ MTNR1B P49286 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
SCHEMBL22866554 1.00 PTPRB (0.33) PTPRBKDM4EUGT8EGFRMTNR1A
SCHEMBL22866572 0.88 UGT8 (0.31) PTPRBUGT8
SCHEMBL29661801 0.88 UGT8 (0.31) PTPRBUGT8
SCHEMBL22866552 0.88 UGT8 (0.31) UGT8
SCHEMBL29661871 0.88 UGT8 (0.31) UGT8
SCHEMBL22866573 0.87 UGT8 (0.33) KDM4EUGT8
SCHEMBL22866783 0.83 SSTR4 (0.31) —
SCHEMBL29560284 0.83 SSTR4 (0.31) —
SCHEMBL22866471 0.81 L3MBTL1 (0.34) KDM4E
SCHEMBL22866574 0.78 HPGDS (0.31) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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