SCHEMBL27360146

SCHEMBL27360146

CN[C@H](C(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H](CO)c1ccc(-c2cccc(F)c2F)cc1)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
VHL P40337 19/20 0.41
ELOC Q15369 3/20 0.38
ELOB Q15370 3/20 0.38
CASP1 P29466 1/20 0.38

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
SCHEMBL27360149 0.86 VHL (0.43) VHLELOCELOBCASP1
SCHEMBL27360156 0.85 VHL (0.43) VHLELOCELOBCASP1
SCHEMBL27360233 0.84 VHL (0.52) VHLELOCELOBCASP1
SCHEMBL30760049 0.82 VHL (0.43) VHLELOCELOB
SCHEMBL27360078 0.82 VHL (0.41) VHL
SCHEMBL30760125 0.82 CMA1 (0.41) VHLCASP1
SCHEMBL27360160 0.80 VHL (0.42) VHLELOCELOBCASP1
SCHEMBL27360153 0.80 VHL (0.42) VHLELOCELOBCASP1
SCHEMBL27359569 0.80 VHL (0.44) VHLELOCELOB
SCHEMBL27359669 0.79 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