SCHEMBL27360160

SCHEMBL27360160

CN[C@H](C(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H](CO)c1ccc(-c2cnccc2Cl)cc1)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
VHL P40337 19/20 0.42
CASP1 P29466 1/20 0.37
ELOC Q15369 3/20 0.36
ELOB Q15370 3/20 0.36

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
SCHEMBL27360153 0.94 VHL (0.42) VHLCASP1ELOCELOB
SCHEMBL27360156 0.84 VHL (0.43) VHLCASP1ELOCELOB
SCHEMBL30760141 0.83 DPP4 (0.47) VHLELOCELOB
SCHEMBL27360091 0.83 VHL (0.41) VHL
SCHEMBL30760163 0.83 VHL (0.40) VHLELOCELOB
SCHEMBL27360146 0.80 VHL (0.41) VHLCASP1ELOCELOB
SCHEMBL27360149 0.79 VHL (0.43) VHLCASP1ELOCELOB
SCHEMBL30760092 0.79 VHL (0.41) VHLELOCELOB
SCHEMBL30760038 0.79 VHL (0.51) VHLELOCELOB
SCHEMBL27359490 0.79 VHL (0.44) 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