SCHEMBL25416363

SCHEMBL25416363

O=C(c1ccc(Br)cc1)N1N=C(c2ccc(N(C(=O)O)C3CS(=O)(=O)C3)cc2)CC1c1ccccn1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 16/20 0.57
▸ BECN1 Q14457 8/20 0.57
▸ PKM P14618 1/20 0.50
▸ CACNA1H O95180 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL25416369 0.93 BCL2 (0.57) BCL2BECN1PKMCACNA1HNPSR1
SCHEMBL25417560 0.89 BCL2 (0.58) BCL2BECN1PKMCACNA1H
SCHEMBL25416384 0.80 BCL2 (0.68) BCL2BECN1PKMCACNA1HNPSR1
SCHEMBL14540890 0.80 BCL2 (0.68) BCL2BECN1PKMCACNA1H
SCHEMBL25560851 0.79 BCL2 (0.61) BCL2BECN1PKMCACNA1HNPSR1
SCHEMBL25414897 0.79 BCL2 (0.77) BCL2BECN1CACNA1H
SCHEMBL25560153 0.79 BCL2 (0.74) BCL2BECN1
SCHEMBL25560205 0.73 BCL2 (0.76) BCL2BECN1
SCHEMBL25414631 0.73 BCL2 (0.71) BCL2BECN1
SCHEMBL23269270 0.73 BCL2 (1.00) BCL2BECN1

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-2023081312-A1 SMALL MOLECULE INDUCERS OF AUTOPHAGY Vir Biotechnology, Inc. (US) 2023-05-11 — — WO disclosed
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