SCHEMBL1957534

SCHEMBL1957534

CC1(C)CCC(CN2CCN(c3ccc(C(=O)N[S+]([O-])c4ccc(OCC5CCC6(CC5)COC6)c([N+](=O)[O-])c4)c(Oc4cnc(N)c(Cl)c4)c3)CC2)=C(c2ccc(Cl)cc2)C1

nearest known ligand 0.75

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 19/20 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
SCHEMBL1958125 0.95 BCL2 (0.82) BCL2
SCHEMBL1953311 0.91 BCL2 (0.91) BCL2
SCHEMBL1956061 0.90 BCL2 (0.83) BCL2
SCHEMBL1958179 0.88 BCL2 (0.59) BCL2
SCHEMBL1961090 0.86 BCL2 (1.00) BCL2
SCHEMBL8515424 0.86 BCL2 (0.76) BCL2
SCHEMBL1956111 0.85 BCL2 (0.76) BCL2
SCHEMBL1869537 0.85 BCL2 (0.76) BCL2
SCHEMBL1955975 0.85 BCL2 (0.91) BCL2
SCHEMBL1955972 0.85 BCL2 (0.91) 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
EP-2507211-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES Abbott Laboratories (US) 2012-10-10 — — EP disclosed
WO-2011068560-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBOTT LABORATORIES (US) 2011-06-09 — — WO disclosed
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