SCHEMBL29017149

SCHEMBL29017149

O=C(Cc1ccc(OC(F)(F)F)cc1)Nc1nnc(N2CC[C@@H](Nc3nc4ncccc4s3)C2)s1

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GLS O94925 20/20 0.60

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
SCHEMBL29017151 1.00 GLS (0.60) GLS
SCHEMBL29017188 0.92 GLS (0.59) GLS
SCHEMBL29017191 0.92 GLS (0.59) GLS
SCHEMBL29017140 0.84 KCNH2 (0.58) GLS
SCHEMBL29017137 0.84 KCNH2 (0.58) GLS
SCHEMBL29017135 0.81 GLS (0.51) GLS
SCHEMBL30337141 0.81 GLS (0.51) GLS
SCHEMBL29017139 0.81 GLS (0.51) GLS
SCHEMBL29017163 0.81 GLS (0.62) GLS
SCHEMBL28457408 0.80 GLS (0.68) GLS

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-115594683-B Glutaminase GLS1 inhibitor and preparation method and application thereof 杭州禹胜医药科技有限公司 2023-06-16 — — CN disclosed
CN-115594683-A Glutaminase GLS1 inhibitor and preparation method and application thereof 杭州禹胜医药科技有限公司(CN) 2023-01-13 — — CN disclosed
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