SCHEMBL26648564

SCHEMBL26648564

COC(=O)c1ccc(N2CCC(C(O)c3cc(CN4CCN(C(=O)O)CC4)ccc3-c3ccc(Cl)cc3)CC2)cc1Oc1cnc2[nH]ccc2c1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BCL2A1 Q16548 3/20 0.49
▸ BID P55957 2/20 0.49
▸ MCL1 Q07820 2/20 0.49
▸ BCL2 P10415 17/20 0.46

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
SCHEMBL26648555 1.00 BCL2A1 (0.49) BCL2A1BIDMCL1BCL2
SCHEMBL26648566 0.93 BCL2 (0.50) BCL2A1BIDMCL1BCL2
SCHEMBL26648571 0.93 BCL2 (0.50) BCL2A1BIDMCL1BCL2
SCHEMBL31450586 0.93 BCL2 (0.50) BCL2A1BIDMCL1BCL2
SCHEMBL31450888 0.93 BCL2 (0.50) BCL2A1BIDMCL1BCL2
SCHEMBL26647789 0.89 BCL2A1 (0.51) BCL2A1BIDMCL1BCL2
SCHEMBL26648052 0.89 BCL2A1 (0.51) BCL2A1BIDMCL1BCL2
SCHEMBL31450986 0.89 BCL2A1 (0.51) BCL2A1BIDMCL1BCL2
SCHEMBL31450479 0.86 BCL2 (0.46) BCL2A1BIDMCL1BCL2
SCHEMBL26648456 0.86 BCL2 (0.46) BCL2A1BIDMCL1BCL2

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-2023220425-A1 BCL-XL/BCL-2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-11-16 — — WO disclosed
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