SCHEMBL25899700

SCHEMBL25899700

Cc1ncsc1-c1ccc(C(C)NC(=O)C2CCCN2C(=O)C(c2cc(OCC3CN(C)C3)no2)C(C)C)cc1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ VHL P40337 17/20 0.60
▸ SMARCA2 P51531 4/20 0.46
▸ SMARCA4 P51532 4/20 0.46
▸ SOS1 Q07889 1/20 0.40
▸ ELOC Q15369 3/20 0.39
▸ ELOB Q15370 3/20 0.39

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
SCHEMBL25893329 0.91 VHL (0.57) VHLSMARCA2SMARCA4SOS1ELOC
SCHEMBL34469717 0.90 VHL (0.61) VHLSMARCA2SMARCA4SOS1ELOC
SCHEMBL21456393 0.89 VHL (0.64) VHLSMARCA2SMARCA4ELOCELOB
SCHEMBL21456410 0.89 VHL (0.60) VHLSMARCA2SMARCA4SOS1ELOC
SCHEMBL21456404 0.89 VHL (0.60) VHLSMARCA2SMARCA4ELOCELOB
SCHEMBL23205395 0.89 VHL (0.60) VHLSMARCA2SMARCA4ELOCELOB
SCHEMBL23205572 0.89 VHL (0.60) VHLSMARCA2SMARCA4SOS1ELOC
SCHEMBL24870169 0.88 VHL (0.54) VHLSMARCA2SMARCA4SOS1
SCHEMBL24757893 0.88 VHL (0.54) VHLSMARCA2SMARCA4SOS1
SCHEMBL23205220 0.88 VHL (0.59) VHLSMARCA2SMARCA4SOS1ELOC

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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