SCHEMBL553691

SCHEMBL553691

CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCC(C(O)c4ccccc4-c4ccc(Cl)cc4)CC3)cc2)cc1[N+](=O)[O-]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 20/20 1.00
▸ BCL2 P10415 14/20 1.00
▸ BCL2L2 Q92843 2/20 0.77
▸ MDM4 O15151 1/20 0.77
▸ BCL2L11 O43521 1/20 0.77
▸ TP53 P04637 1/20 0.77
▸ BID P55957 1/20 0.77
▸ BAX Q07812 1/20 0.77
▸ MCL1 Q07820 1/20 0.77
▸ ASPH Q12797 1/20 0.77
▸ BECN1 Q14457 1/20 0.77
▸ BAK1 Q16611 1/20 0.77
▸ BAD Q92934 1/20 0.77
▸ BBC3 Q9BXH1 1/20 0.77
▸ ALB P02768 1/20 0.69

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
SCHEMBL553692 1.00 BCL2L1 (1.00) BCL2L1BCL2BCL2L2MDM4BCL2L11
SCHEMBL554672 1.00 BCL2L1 (1.00) BCL2L1BCL2BCL2L2MDM4BCL2L11
SCHEMBL553690 1.00 BCL2L1 (1.00) BCL2L1BCL2BCL2L2MDM4BCL2L11
SCHEMBL554070 0.91 BCL2L1 (1.00) BCL2L1BCL2
SCHEMBL554782 0.91 BCL2L1 (1.00) BCL2L1BCL2
SCHEMBL554071 0.91 BCL2L1 (1.00) BCL2L1BCL2
SCHEMBL554648 0.91 BCL2L1 (1.00) BCL2L1BCL2
SCHEMBL3962942 0.91 BCL2L1 (0.83) BCL2L1BCL2BCL2L2MDM4BCL2L11
SCHEMBL1540286 0.90 BCL2L1 (0.84) BCL2L1BCL2BCL2L2MDM4BCL2L11
SCHEMBL554482 0.90 BCL2L1 (0.81) BCL2L1BCL2BCL2L2MDM4BCL2L11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160176906-A1 Chemical Compounds ASTRAZENECA AB (SE) 2016-06-23 — — US disclosed
US-9248140-B2 Chemical compounds ASTRAZENECA AB (SE) 2016-02-02 — — US disclosed
US-20150328239-A1 Chemical Compounds ASTRAZENECA AB (SE) 2015-11-19 — — US disclosed
US-9018381-B2 Chemical compounds ASTRAZENECA AB (SE) 2015-04-28 — — US disclosed
US-20130310344-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ASTRAZENECA AB (UK) 2013-11-21 — — US disclosed
EP-2601177-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS AstraZeneca AB (SE) 2013-06-12 — — EP disclosed
US-20120035134-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-02-09 — — US disclosed
WO-2012017251-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ASTRAZENECA AB (SE) 2012-02-09 — — 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 (4 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-20120035134-A1 CHEMICAL COMPOUNDS BCL2, BCL2L1, BAX BCL2L1 2/4885BCL2 1/4885BCL2L2 5/4885
US-20150328239-A1 Chemical Compounds BCL2, BCL2L1, BAX BCL2L1 2/4885BCL2 1/4885BCL2L2 5/4885
US-20160176906-A1 Chemical Compounds BCL2, BCL2L1, BAX BCL2L1 2/4885BCL2 1/4885BCL2L2 5/4885
US-20130310344-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BCL2, BAX, BCLAF1 BCL2L1 6/4885BCL2 1/4885BCL2L2 8/4885

“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.

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