SCHEMBL27831700

SCHEMBL27831700

O=C(O)N1CCC(Oc2ccc(S(=O)(=O)Nc3ncnc4cc(N5CCN(Cc6ccccc6-c6ccccc6)CC5)ccc34)cc2[N+](=O)[O-])CC1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 9/20 0.55
▸ BCL2L1 Q07817 5/20 0.55
▸ BCL2L2 Q92843 3/20 0.55

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
SCHEMBL1111924 0.93 BCL2 (0.56) BCL2BCL2L1BCL2L2
SCHEMBL1677855 0.92 BCL2 (0.56) BCL2BCL2L1BCL2L2
SCHEMBL1677621 0.92 BCL2 (0.53) BCL2BCL2L1BCL2L2
SCHEMBL1111862 0.91 BCL2 (0.55) BCL2BCL2L1BCL2L2
SCHEMBL27811380 0.89 BCL2 (0.60) BCL2BCL2L1BCL2L2
SCHEMBL1111798 0.85 BCL2 (0.56) BCL2BCL2L1BCL2L2
SCHEMBL1111919 0.84 BCL2 (0.56) BCL2BCL2L1BCL2L2
SCHEMBL1112136 0.84 BCL2 (0.58) BCL2BCL2L1BCL2L2
SCHEMBL3715436 0.83 BCL2L1 (0.58) BCL2BCL2L1BCL2L2
SCHEMBL1112004 0.82 BCL2 (0.66) BCL2BCL2L1BCL2L2

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
CN-102105449-A Arylsulfonamide compounds, compositions and methods of use GENENTECH INC 2011-06-22 — — CN disclosed
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