SCHEMBL27360153

SCHEMBL27360153

CN[C@H](C(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H](CO)c1ccc(-c2ccncc2Cl)cc1)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
VHL P40337 18/20 0.42
DPP4 P27487 1/20 0.41
ELOC Q15369 3/20 0.36
ELOB Q15370 3/20 0.36
CASP1 P29466 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
SCHEMBL27360160 0.94 VHL (0.42) VHLELOCELOBCASP1
SCHEMBL30760141 0.89 DPP4 (0.47) VHLDPP4ELOCELOB
SCHEMBL30760163 0.89 VHL (0.40) VHLDPP4ELOCELOB
SCHEMBL30760092 0.85 VHL (0.41) VHLDPP4ELOCELOB
SCHEMBL27360156 0.84 VHL (0.43) VHLELOCELOBCASP1
SCHEMBL30760025 0.83 POLB (0.43) VHLDPP4ELOCELOB
SCHEMBL27360088 0.83 VHL (0.42) VHLDPP4
SCHEMBL30760038 0.80 VHL (0.51) VHLDPP4ELOCELOB
SCHEMBL27360146 0.80 VHL (0.41) VHLELOCELOBCASP1
SCHEMBL30760086 0.80 VHL (0.47) 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