SCHEMBL4469309

SCHEMBL4469309

COc1cc(CCN(C)CCN(C)C)ccc1-c1ccc(C(=O)NS(=O)(=O)c2ccc(N[C@H](CCCCNC(=O)O)CSc3ccccc3)c([N+](=O)[O-])c2)cc1

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 20/20 0.73
BCL2 P10415 17/20 0.73
ALB P02768 1/20 0.71

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
SCHEMBL4469316 1.00 BCL2L1 (0.73) BCL2L1BCL2ALB
SCHEMBL5743859 0.97 BCL2L1 (0.68) BCL2L1BCL2ALB
SCHEMBL5743852 0.97 BCL2L1 (0.68) BCL2L1BCL2ALB
SCHEMBL2948360 0.95 BCL2L1 (0.68) BCL2L1BCL2ALB
SCHEMBL2948357 0.95 BCL2L1 (0.68) BCL2L1BCL2ALB
SCHEMBL2947592 0.93 BCL2L1 (0.78) BCL2L1BCL2ALB
SCHEMBL2952203 0.89 BCL2L1 (0.83) BCL2L1BCL2ALB
SCHEMBL4474744 0.88 BCL2L1 (0.78) BCL2L1BCL2ALB
SCHEMBL2952588 0.87 BCL2L1 (0.74) BCL2L1BCL2ALB
SCHEMBL2943299 0.86 BCL2L1 (0.77) BCL2L1BCL2ALB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504512-B2 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES (US) 2009-03-17 US disclosed
US-20040192681-A1 N-acylsulfonamide apoptosis promoters ABBVIE INC. 2004-09-30 US disclosed
US-6720338-B2 BCL-X1 INHIBITING COMPOSITIONS AND METHODS OF PROMOTING APOPTOSIS IN A MAMMAL ABBOTT LABORATORIES 2004-04-13 US disclosed
US-20020086887-A1 N-Acylsulfonamide apoptosis promoters ABBVIE INC. 2002-07-04 US disclosed
US-20020055631-A1 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES 2002-05-09 US 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 (3 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-20020086887-A1 N-Acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 BCL2L1 5/4885BCL2 3/4885ALB 4765/4885
US-20020055631-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 BCL2L1 4/4885BCL2 3/4885ALB 4718/4885
US-20040192681-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 BCL2L1 5/4885BCL2 3/4885ALB 4765/4885

“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.