SCHEMBL554482

SCHEMBL554482

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

nearest known ligand 0.81

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 19/20 0.81
▸ BCL2 P10415 14/20 0.81
▸ MDM4 O15151 1/20 0.70
▸ BCL2L11 O43521 1/20 0.70
▸ TP53 P04637 1/20 0.70
▸ BID P55957 1/20 0.70
▸ BAX Q07812 1/20 0.70
▸ MCL1 Q07820 1/20 0.70
▸ ASPH Q12797 1/20 0.70
▸ BECN1 Q14457 1/20 0.70
▸ BAK1 Q16611 1/20 0.70
▸ BCL2L2 Q92843 1/20 0.70
▸ BAD Q92934 1/20 0.70
▸ BBC3 Q9BXH1 1/20 0.70

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
SCHEMBL554480 1.00 BCL2L1 (0.81) BCL2L1BCL2MDM4BCL2L11TP53
SCHEMBL554481 1.00 BCL2L1 (0.81) BCL2L1BCL2MDM4BCL2L11TP53
SCHEMBL16300840 0.93 BCL2 (0.69) BCL2L1BCL2
SCHEMBL553948 0.93 BCL2L1 (0.81) BCL2L1BCL2
SCHEMBL553949 0.93 BCL2L1 (0.81) BCL2L1BCL2
SCHEMBL553947 0.93 BCL2L1 (0.81) BCL2L1BCL2
SCHEMBL16300049 0.90 BAD (0.67) BCL2L1BCL2BAD
SCHEMBL553692 0.90 BCL2L1 (1.00) BCL2L1BCL2MDM4BCL2L11TP53
SCHEMBL553690 0.90 BCL2L1 (1.00) BCL2L1BCL2MDM4BCL2L11TP53
SCHEMBL553691 0.90 BCL2L1 (1.00) BCL2L1BCL2MDM4BCL2L11TP53

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-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
US-20120035134-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-02-09 — — 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 (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 1/4885MDM4 3293/4885
US-20150328239-A1 Chemical Compounds BCL2, BCL2L1, BAX BCL2L1 2/4885BCL2 1/4885MDM4 3293/4885
US-20160176906-A1 Chemical Compounds BCL2, BCL2L1, BAX BCL2L1 2/4885BCL2 1/4885MDM4 3293/4885
US-20130310344-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BCL2, BAX, BCLAF1 BCL2L1 6/4885BCL2 1/4885MDM4 3747/4885

“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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