SCHEMBL25422286

SCHEMBL25422286

CN(C)CCC(CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C=O)C4)CC3)cc2)cc1[N+](=O)[O-]

nearest known ligand 0.88

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BAD Q92934 2/20 0.88
▸ BCL2 P10415 11/20 0.79
▸ BCL2L1 Q07817 18/20 0.74
▸ BCL2L2 Q92843 2/20 0.74
▸ MDM4 O15151 1/20 0.74
▸ BCL2L11 O43521 1/20 0.74
▸ TP53 P04637 1/20 0.74
▸ BID P55957 1/20 0.74
▸ BAX Q07812 1/20 0.74
▸ MCL1 Q07820 1/20 0.74
▸ ASPH Q12797 1/20 0.74
▸ BECN1 Q14457 1/20 0.74
▸ BAK1 Q16611 1/20 0.74
▸ BBC3 Q9BXH1 1/20 0.74
▸ ALB P02768 1/20 0.68

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
SCHEMBL25422283 1.00 BAD (0.88) BADBCL2BCL2L1BCL2L2MDM4
SCHEMBL1541222 0.94 BAD (1.00) BADBCL2BCL2L1BCL2L2MDM4
SCHEMBL1540844 0.90 BCL2 (0.87) BADBCL2BCL2L1BCL2L2MDM4
SCHEMBL2023941 0.90 BCL2 (0.87) BADBCL2BCL2L1BCL2L2MDM4
SCHEMBL1541327 0.90 BCL2 (0.86) BADBCL2BCL2L1BCL2L2MDM4
SCHEMBL1541323 0.90 BCL2 (0.86) BADBCL2BCL2L1BCL2L2MDM4
SCHEMBL1541555 0.90 BCL2 (0.86) BADBCL2BCL2L1BCL2L2MDM4
Hydrochloric Acid SCHEMBL25421407 0.89 BAD (0.83) BADBCL2BCL2L1BCL2L2MDM4
Hydrochloric Acid SCHEMBL25421393 0.89 BAD (0.83) BADBCL2BCL2L1BCL2L2MDM4
SCHEMBL2019324 0.89 BCL2 (1.00) BADBCL2BCL2L1BCL2L2MDM4

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-2023107606-A1 BCL-XL/BCL-2 DUAL DEGRADERS FOR TREATMENT OF CANCERS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2023-06-15 — — WO disclosed
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