SCHEMBL4462334

SCHEMBL4462334

O=C(NS(=O)(=O)c1ccc(NCCSc2ccccc2)c([N+](=O)[O-])c1)c1ccc(-c2ccc(CCC(=O)N3CCCCC3)c3cccnc23)cc1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 20/20 0.62
BCL2 P10415 16/20 0.62
BAK1 Q16611 1/20 0.59
MCL1 Q07820 6/20 0.57

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
SCHEMBL2941753 0.94 BCL2L1 (0.71) BCL2L1BCL2BAK1MCL1
SCHEMBL2943485 0.94 BCL2L1 (0.63) BCL2L1BCL2BAK1MCL1
SCHEMBL2951627 0.91 BCL2L1 (0.52) BCL2L1BCL2BAK1MCL1
SCHEMBL2947097 0.88 BCL2L1 (0.70) BCL2L1BCL2BAK1MCL1
SCHEMBL2952572 0.87 BCL2L1 (0.64) BCL2L1BCL2BAK1MCL1
SCHEMBL2945124 0.86 BCL2L1 (0.71) BCL2L1BCL2BAK1MCL1
SCHEMBL2951514 0.86 BCL2L1 (0.64) BCL2L1BCL2BAK1MCL1
SCHEMBL2950158 0.85 BCL2L1 (0.63) BCL2L1BCL2BAK1MCL1
SCHEMBL2949176 0.84 BCL2L1 (0.72) BCL2L1BCL2BAK1MCL1
SCHEMBL2947979 0.80 BCL2L1 (0.60) BCL2L1BCL2BAK1MCL1

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 6 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
EP-1318978-B1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LAB (US) 2006-02-08 EP 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 3/4885BAK1 23/4885
US-20020055631-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 BCL2L1 4/4885BCL2 3/4885BAK1 25/4885
US-20040192681-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 BCL2L1 5/4885BCL2 3/4885BAK1 23/4885

“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.