SCHEMBL26647979

SCHEMBL26647979

CC1(C)CCC(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(NCC5CCNCC5)c(S(=O)(=O)C(F)(F)F)c4)c(Oc4cnc5[nH]ccc5c4)c3)CC2)=C(c2ccc(Cl)cc2)C1

nearest known ligand 0.90

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 20/20 0.90
▸ BCL2L1 Q07817 2/20 0.76
▸ MCL1 Q07820 2/20 0.76
▸ BCL2L2 Q92843 2/20 0.76
▸ NSD2 O96028 1/20 0.76
▸ ADORA3 P0DMS8 1/20 0.76
▸ CYP2C9 P11712 1/20 0.76
▸ ADRA2C P18825 1/20 0.76
▸ SLC6A2 P23975 1/20 0.76
▸ BID P55957 1/20 0.76
▸ SLC6A3 Q01959 1/20 0.76
▸ ASPH Q12797 1/20 0.76
▸ BAD Q92934 1/20 0.76
▸ NSD1 Q96L73 1/20 0.76
▸ NSD3 Q9BZ95 1/20 0.76
▸ TMEM97 Q5BJF2 1/20 0.75

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
SCHEMBL31450908 1.00 BCL2 (0.90) BCL2BCL2L1MCL1BCL2L2NSD2
SCHEMBL26648486 0.96 BCL2 (0.89) BCL2BCL2L1MCL1BCL2L2NSD2
SCHEMBL31450997 0.96 BCL2 (0.89) BCL2BCL2L1MCL1BCL2L2NSD2
SCHEMBL25333323 0.95 BCL2 (0.86) BCL2BCL2L1MCL1BCL2L2NSD2
SCHEMBL30485139 0.95 BCL2 (0.86) BCL2BCL2L1MCL1BCL2L2NSD2
SCHEMBL25333332 0.95 BCL2 (0.86) BCL2BCL2L1MCL1BCL2L2NSD2
SCHEMBL1702331 0.95 BCL2 (1.00) BCL2BCL2L1MCL1BCL2L2NSD2
SCHEMBL30314207 0.95 BCL2 (1.00) BCL2BCL2L1MCL1BCL2L2NSD2
SCHEMBL31450956 0.94 BCL2 (0.90) BCL2
SCHEMBL26648270 0.94 BCL2 (0.90) BCL2

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