Halostachine

Halostachine

SCHEMBL5075636

CNC[C@H](O)c1ccccc1.O=CO

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
HIF1A Q16665 3/20 0.56
HTR1A P08908 2/20 0.56
BLM P54132 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
TAAR1 Q96RJ0 2/20 0.56
ALDH1A1 P00352 2/20 0.56
CYP2C9 P11712 2/20 0.56
THPO P40225 1/20 0.56
NMUR2 Q9GZQ4 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
SLC6A3 Q01959 3/20 0.54
RAB9A P51151 2/20 0.54
ADRB2 P07550 1/20 0.54
ADRB1 P08588 1/20 0.54
ADRA2A P08913 1/20 0.54
ADRB3 P13945 1/20 0.54
TSHR P16473 1/20 0.54
ADRA2B P18089 1/20 0.54

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
Halostachine SCHEMBL5073538 1.00 KDM4E (0.62) KDM4EL3MBTL1HIF1AHTR1ABLM
Halostachine SCHEMBL11007060 0.90 KDM4E (0.68) KDM4EL3MBTL1HIF1AHTR1ABLM
Halostachine SCHEMBL932123 0.90 KDM4E (0.68) KDM4EL3MBTL1HIF1AHTR1ABLM
Halostachine SCHEMBL5076853 0.90 KDM4E (0.68) KDM4EL3MBTL1HIF1AHTR1ABLM
Halostachine SCHEMBL210960 0.90 KDM4E (0.68) KDM4EL3MBTL1HIF1AHTR1ABLM
Halostachine SCHEMBL30473042 0.88 KDM4E (0.65) KDM4EL3MBTL1HIF1AHTR1ABLM
Halostachine SCHEMBL18329334 0.85 KDM4E (0.57) KDM4EL3MBTL1HIF1AHTR1ABLM
Halostachine SCHEMBL28853304 0.83 HIF1A (0.75) KDM4EL3MBTL1HIF1AHTR1ABLM
Halostachine SCHEMBL18329341 0.82 KDM4E (0.53) KDM4EL3MBTL1HIF1AHTR1ABLM
SCHEMBL25555025 0.78 KDM4E (0.68) KDM4EL3MBTL1SMN1; SMN2ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080312242-A1 7-ARYL-3, 9-DIAZABICYCLO(3.3.1)NON-6-ENE DERIVATIVES AND THEIR USE AS RENIN INHIBITORS IN THE TREATMENT OF HYPERTENSION, CARDIOVASCULAR OR RENAL DISEASES ACTELION PHARMACEUTICALS, LTD. (CH) 2008-12-18 US disclosed
US-7427613-B2 7-aryl-3,9-diazabicyclo(3.3.1)non-6-ene derivatives and their use as renin inhibitors in the treatment of hypertension, cardiovascular or renal diseases ACTELION PHARMACEUTICALS LTD. (CH) 2008-09-23 US disclosed
US-20050176700-A1 7-aryl-3,9-diazabicyclo(3.3.1)non-6-ene derivatives and their use as renin inhibitors in the treatment of hypertension,cardiovascular or renal diseases ACTELION PHARMACEUTICALS LTD. (CH) 2005-08-11 US disclosed
EP-1501830-A1 7-ARYL-3,9-DIAZABICYCLO[3.3.1]NON-6-ENE DERIVATIVES AND THEIR USE AS RENIN INHIBITORS IN THE TREATMENT OF HYPERTENSION, CARDIOVASCULAR OR RENAL DISEASES Actelion Pharmaceuticals Ltd. (CH) 2005-02-02 EP disclosed
WO-2003093267-A1 7-ARYL-3,9-DIAZABICYCLO(3.3.1)NON-6-ENE DERIVATIVES AND THEIR USE AS RENIN INHIBITORS IN THE TREATMENT OF HYPERTENSION, CARDIOVASCULAR OR RENAL DISEASES ACTELION PHARMACEUTICALS LTD (CH) 2003-11-13 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 (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-20050176700-A1 7-aryl-3,9-diazabicyclo(3.3.1)non-6-ene derivatives and their use as renin inhibitors in the treatment of hypertension,cardiovascular or renal diseases REN, AGTR1, ACE KDM4E 799/4885L3MBTL1 4871/4885HIF1A 2021/4885
US-20080312242-A1 7-ARYL-3, 9-DIAZABICYCLO(3.3.1)NON-6-ENE DERIVATIVES AND THEIR USE AS RENIN INHIBITORS IN THE TREATMENT OF HYPERTENSION, CARDIOVASCULAR OR RENAL DISEASES REN, AGTR1, ACE KDM4E 799/4885L3MBTL1 4871/4885HIF1A 2021/4885

“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.