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Sugi Predict / Compounds / SCHEMBL27360089

SCHEMBL27360089

SCHEMBL27360089

CC(C)[C@@H](C(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H](CO)c1ccc(-c2c(F)cncc2F)cc1)n1cc(C(C)(C)C)nn1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ VHL P40337 20/20 0.41
▸ ELOC Q15369 1/20 0.35
▸ ELOB Q15370 1/20 0.35

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
SCHEMBL27359850 0.91 VHL (0.49) VHLELOCELOB
SCHEMBL27360084 0.88 VHL (0.44) VHL
SCHEMBL27359963 0.86 VHL (0.48) VHLELOCELOB
SCHEMBL27359824 0.85 VHL (0.49) VHLELOCELOB
SCHEMBL27359842 0.84 VHL (0.47) VHLELOCELOB
SCHEMBL27360076 0.83 VHL (0.42) VHL
SCHEMBL27359944 0.83 VHL (0.49) VHLELOCELOB
SCHEMBL27360073 0.82 VHL (0.42) VHL
SCHEMBL27360156 0.81 VHL (0.43) VHLELOCELOB
SCHEMBL27359826 0.81 VHL (0.50) VHLELOCELOB

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-2024040080-A1 KRAS INHIBITOR CONJUGATES ERASCA, INC. (US) 2024-02-22 — — WO disclosed