SCHEMBL1112736

SCHEMBL1112736

CN(C)CC[C@H](CSc1ccccc1)Oc1ccc(S(=O)(=O)Nc2ncnc3cc(N4CCN(CC5=C(c6ccc(Cl)cc6)CCCC5)CC4)ccc23)cc1C(F)(F)F

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 19/20 0.63
BCL2L1 Q07817 15/20 0.63
BCL2L2 Q92843 4/20 0.63
BAD Q92934 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
SCHEMBL1112742 1.00 BCL2 (0.63) BCL2BCL2L1BCL2L2BAD
SCHEMBL1112092 0.89 BCL2 (0.75) BCL2BCL2L1BCL2L2BAD
SCHEMBL1112089 0.89 BCL2 (0.75) BCL2BCL2L1BCL2L2BAD
SCHEMBL1677787 0.89 BCL2 (0.75) BCL2BCL2L1BCL2L2BAD
SCHEMBL1677785 0.89 BCL2 (0.75) BCL2BCL2L1BCL2L2BAD
SCHEMBL1677665 0.86 BCL2 (0.65) BCL2BCL2L1BCL2L2BAD
SCHEMBL1112488 0.86 BCL2 (0.72) BCL2BCL2L1BCL2L2BAD
SCHEMBL1677664 0.86 BCL2 (0.65) BCL2BCL2L1BCL2L2BAD
SCHEMBL1112492 0.86 BCL2 (0.72) BCL2BCL2L1BCL2L2BAD
SCHEMBL1678116 0.86 BCL2 (0.71) BCL2BCL2L1BCL2L2BAD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110098305-A1 ARYLSULFONAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF USE BAELL JONATHAN BAYLDON 2011-04-28 US disclosed
EP-2279174-A2 ARYLSULFONAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF USE Genentech, Inc. (US) 2011-02-02 EP disclosed
WO-2009143246-A2 ARYLSULFONAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF USE GENENTECH, INC. (US) 2009-11-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110098305-A1 ARYLSULFONAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF USE BAX, API5, BCL2 BCL2 3/4885BCL2L1 13/4885BCL2L2 22/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.