SCHEMBL6469780

SCHEMBL6469780

CCCN(CSc1ccccc1)C1(S(N)(=O)=O)C=CC=C([N+](=O)[O-])C1N(C)C

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.34

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
SCHEMBL6533266 0.64 BCL2L1 (0.31) BCL2L1
SCHEMBL6025616 0.62 BCL2L1 (0.30) BCL2L1
SCHEMBL9129233 0.60 TDP1 (0.30)
SCHEMBL4893204 0.57 BCL2L1 (0.35) BCL2L1
SCHEMBL26618282 0.53 FDPS (0.55)
SCHEMBL4368896 0.49 ALDH1A1 (0.48)
SCHEMBL7068301 0.49 CA2 (0.64)
SCHEMBL11807975 0.49 ALDH1A1 (0.43)
SCHEMBL5880844 0.49 ALDH1A1 (0.46)
Nitrobenzene SCHEMBL27494790 0.49 ALDH1A1 (0.64)

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-2005049593-A2 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2005-06-02 WO disclosed