SCHEMBL1542094

SCHEMBL1542094

CC(C)(C)N(CCCC[C@H](CSc1ccccc1)Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 19/20 0.70
BCL2 P10415 13/20 0.54
BCL2L2 Q92843 2/20 0.49
ALB P02768 1/20 0.49
DOT1L Q8TEK3 1/20 0.46

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
SCHEMBL2027016 1.00 BCL2L1 (0.70) BCL2L1BCL2BCL2L2ALBDOT1L
SCHEMBL1541685 0.87 BCL2L1 (0.88) BCL2L1BCL2BCL2L2ALBDOT1L
SCHEMBL1542046 0.85 BCL2L1 (0.89) BCL2L1BCL2BCL2L2ALBDOT1L
SCHEMBL27671268 0.85 BCL2L1 (0.89) BCL2L1BCL2BCL2L2ALBDOT1L
SCHEMBL2674775 0.83 BCL2L1 (0.69) BCL2L1BCL2BCL2L2ALBDOT1L
SCHEMBL2674778 0.83 BCL2L1 (0.69) BCL2L1BCL2BCL2L2ALBDOT1L
SCHEMBL29686481 0.83 BCL2L1 (1.00) BCL2L1BCL2BCL2L2ALB
SCHEMBL554723 0.83 BCL2L1 (1.00) BCL2L1BCL2BCL2L2ALB
SCHEMBL376632 0.83 BCL2L1 (1.00) BCL2L1BCL2BCL2L2ALB
SCHEMBL2950088 0.83 BCL2L1 (0.63) BCL2L1BCL2BCL2L2ALBDOT1L

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8173811-B2 Apoptosis promoters ABBOTT LABORATORIES (US) 2012-05-08 US disclosed
US-20110256129-A1 APOPTOSIS PROMOTERS ABBOTT LABORATORIES 2011-10-20 US disclosed
US-7973161-B2 Apoptosis promoters ABBOTT LABORATORIES (US) 2011-07-05 US disclosed
US-20110144112-A9 APOPTOSIS PROMOTERS ABBVIE INC. 2011-06-16 US disclosed
EP-2308812-A2 N-acylsulfonamide apoptosis promoters Abbott Laboratories (US) 2011-04-13 EP disclosed
US-20100240715-A1 Apoptosis promoters ABBOTT LABORATORIES 2010-09-23 US disclosed
US-7642260-B2 N-acylsulfonamide derivatives; BCL-X1 protein inhibitors; anticarcinogenic agents; bladder cancer; for example, N-(4-(4-((4'-chloro(1,1'-biphenyl)-2-yl)methyl)piperazin-1-yl)benzoyl)-4-(((1R)-3-(dimethylamino)-1-((phenylsulfanyl)methyl)-propyl)amino)-3-nitrobenzenesulfonamide ABBOTT LABORATORIES, INC. (US) 2010-01-05 US disclosed
US-20060258657-A1 Apoptosis promoters ABBVIE INC. 2006-11-16 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 (5 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-20110144112-A9 APOPTOSIS PROMOTERS BAX, BCL2, API5 BCL2L1 10/4885BCL2 2/4885BCL2L2 16/4885
US-20020055631-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 BCL2L1 4/4885BCL2 3/4885BCL2L2 18/4885
US-20060258657-A1 Apoptosis promoters BAX, BCL2, API5 BCL2L1 10/4885BCL2 2/4885BCL2L2 16/4885
US-20100240715-A1 Apoptosis promoters BAX, BCL2, API5 BCL2L1 10/4885BCL2 2/4885BCL2L2 16/4885
US-20110256129-A1 APOPTOSIS PROMOTERS BAX, BCL2, API5 BCL2L1 10/4885BCL2 2/4885BCL2L2 16/4885

“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.