SCHEMBL25893485

SCHEMBL25893485

Cc1ncsc1-c1ccc(C(C)NC(=O)C2CCCN2C(=O)Cc2cc(OCC3CCNCC3)no2)cc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ VHL P40337 12/20 0.46
▸ ELOC Q15369 1/20 0.44
▸ ELOB Q15370 1/20 0.44
▸ ACACB O00763 4/20 0.41
▸ SOS1 Q07889 1/20 0.38
▸ SMARCA2 P51531 2/20 0.37
▸ SMARCA4 P51532 2/20 0.37
▸ EGFR P00533 2/20 0.37

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
SCHEMBL25899255 0.89 VHL (0.45) VHLELOCELOBACACBSOS1
SCHEMBL25893329 0.89 VHL (0.57) VHLELOCELOBSOS1SMARCA2
SCHEMBL25903959 0.87 VHL (0.44) VHLELOCELOBACACBSOS1
SCHEMBL25896727 0.87 VHL (0.45) VHLELOCELOBACACBSOS1
SCHEMBL25769171 0.87 VHL (0.58) VHLELOCELOBACACBSOS1
SCHEMBL23205254 0.86 VHL (0.52) VHLELOCELOBSOS1EGFR
SCHEMBL25898817 0.85 VHL (0.51) VHLELOCELOBSOS1
SCHEMBL25900160 0.84 VHL (0.48) VHLELOCELOBACACBSMARCA2
SCHEMBL25900704 0.83 VHL (0.45) VHLELOCELOBSOS1EGFR
SCHEMBL25894289 0.82 VHL (0.48) VHLELOCELOBSOS1SMARCA2

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-2023141570-A2 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF KRAS ARVINAS OPERATIONS, INC. (US) 2023-07-27 — — WO disclosed
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