SCHEMBL27811380

SCHEMBL27811380

O=C(O)N1CCC(Nc2ccc(S(=O)(=O)Nc3ncnc4cc(N5CCN(Cc6ccccc6-c6ccccc6)CC5)ccc34)cc2[N+](=O)[O-])CC1

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 10/20 0.60
▸ BCL2L1 Q07817 9/20 0.60
▸ BCL2L2 Q92843 3/20 0.60

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
SCHEMBL1112136 0.93 BCL2 (0.58) BCL2BCL2L1BCL2L2
SCHEMBL1677546 0.92 BCL2 (0.61) BCL2BCL2L1BCL2L2
SCHEMBL1112004 0.92 BCL2 (0.66) BCL2BCL2L1BCL2L2
SCHEMBL27831700 0.89 BCL2 (0.55) BCL2BCL2L1BCL2L2
SCHEMBL1112021 0.87 BCL2 (0.59) BCL2BCL2L1BCL2L2
SCHEMBL1677579 0.85 BCL2L1 (0.69) BCL2BCL2L1BCL2L2
SCHEMBL1111768 0.85 BCL2 (0.60) BCL2BCL2L1BCL2L2
SCHEMBL1677774 0.84 BCL2 (0.63) BCL2BCL2L1BCL2L2
SCHEMBL1677817 0.84 BCL2 (0.61) BCL2BCL2L1BCL2L2
SCHEMBL1677292 0.84 BCL2 (0.61) 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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