SCHEMBL29644474

SCHEMBL29644474

O=C(NS(=O)(=O)c1ccc(NCC2CCCOC2)c([N+](=O)[O-])c1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 14/20 0.54
BCL2 P10415 11/20 0.54
MCL1 Q07820 8/20 0.54
ALDH1A1 P00352 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MAPT P10636 3/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HCAR3 P49019 1/20 0.47

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
SCHEMBL30622006 1.00 BCL2L1 (0.54) BCL2L1BCL2MCL1ALDH1A1SMN1; SMN2
SCHEMBL30112818 0.90 BCL2 (0.46) BCL2L1BCL2MCL1ALDH1A1SMN1; SMN2
SCHEMBL1955748 0.90 BCL2L1 (0.59) BCL2L1BCL2MCL1MAPTMAPK1
SCHEMBL14655243 0.89 MAPT (0.59) BCL2L1BCL2MCL1ALDH1A1SMN1; SMN2
SCHEMBL29855685 0.85 BCL2L1 (0.58) BCL2L1BCL2MCL1
SCHEMBL30019361 0.85 BCL2L1 (0.54) BCL2L1BCL2MCL1ALDH1A1SMN1; SMN2
SCHEMBL30112869 0.84 BCL2L1 (0.58) BCL2L1BCL2MCL1ALDH1A1SMN1; SMN2
SCHEMBL29588224 0.83 BCL2L1 (0.53) BCL2L1BCL2MCL1MAPTMAPK1
SCHEMBL30112781 0.83 BCL2L1 (0.57) BCL2L1BCL2MCL1ALDH1A1SMN1; SMN2
SCHEMBL29588272 0.83 BCL2L1 (0.57) BCL2L1BCL2MCL1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295183-A1 HOT MELT EXTRUDED SOLID DISPERSIONS CONTAINING A BCL2 INHIBITOR NEWAVE PHARMACEUTICAL INC. 2023-09-21 US disclosed
CN-116621860-A Bcl-2 inhibitors 广州麓鹏制药有限公司 2023-08-22 CN disclosed
CN-111511748-B Bcl-2 inhibitors 广州麓鹏制药有限公司 2023-05-02 CN disclosed
CN-111448198-B Condensed heterocyclic derivatives as Bcl-2 inhibitors for the treatment of neonatal diseases 广州麓鹏制药有限公司 2023-02-03 CN disclosed
CN-115484933-A Hot melt extrusion solid dispersions containing BCL2 inhibitors 广州麓鹏制药有限公司 2022-12-16 CN disclosed
US-20220372042-A1 CONDENSED HETEROCYCLES AS BCL-2 INHIBITORS NEWAVE PHARMACEUTICAL INC. 2022-11-24 US disclosed
CN-110483501-B N- (phenylsulfonyl) benzamides and related compounds as BCL-2 inhibitors 密歇根大学董事会 2022-07-01 CN 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 (2 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-20230295183-A1 HOT MELT EXTRUDED SOLID DISPERSIONS CONTAINING A BCL2 INHIBITOR BCL2, BCL2L1, BCL2L2 BCL2L1 2/4885BCL2 1/4885MCL1 16/4885
US-20220372042-A1 CONDENSED HETEROCYCLES AS BCL-2 INHIBITORS BCL2L11, BCL2L10, BCL2 BCL2L1 4/4885BCL2 3/4885MCL1 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.