SCHEMBL6581656

SCHEMBL6581656

COc1ccccc1Oc1c(Cl)nc(-c2cccnn2)nc1Cl

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DHPS P49366 15/20 0.52
LMNA P02545 1/20 0.39
ALDH1A1 P00352 2/20 0.37
MAPK1 P28482 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
HTT P42858 1/20 0.37
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
FFAR1 O14842 1/20 0.36
HPGD P15428 1/20 0.35

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
SCHEMBL9423908 0.83 LMNA (0.55) DHPSLMNAALDH1A1L3MBTL1MAPT
SCHEMBL29770374 0.79 DHPS (0.58) DHPS
SCHEMBL618135 0.79 DHPS (0.58) DHPS
SCHEMBL7700308 0.77 DHPS (0.51) DHPSLMNAALDH1A1L3MBTL1MAPT
SCHEMBL7303389 0.77 DHPS (0.81) DHPSLMNAALDH1A1HTTMAPT
SCHEMBL4071996 0.76 DHPS (0.67) DHPSGAA
SCHEMBL7204802 0.76 DHPS (0.57) DHPSALDH1A1MAPK1L3MBTL1HTT
SCHEMBL5632471 0.76 DHPS (0.57) DHPSALDH1A1MAPK1L3MBTL1HTT
SCHEMBL7294963 0.76 DHPS (0.62) DHPSALDH1A1MAPTMEN1GAA
SCHEMBL6579232 0.75 EDNRA (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1191026-B1 New pyridazine endothelin antagonists PFIZER LTD (GB) 2004-05-19 EP disclosed
US-6670362-B2 Treatment of restenosis, acute or chronic renal failure, pulmonary hypertension, systemic hypertension, benign prostatic hyperplasia, male erectile dysfunction, prostate cancer, metastatic bone cancer, angina, atherosclerosis PFIZER INC. 2003-12-30 US disclosed
US-20020061889-A1 New pyridazine endothelin antagonists PFIZER INC. 2002-05-23 US disclosed
EP-1191026-A1 New pyridazine endothelin antagonists Pfizer Limited (GB) 2002-03-27 EP 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 (1 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-20020061889-A1 New pyridazine endothelin antagonists EDNRB, EDNRA, ECE1 DHPS 1992/4885LMNA 935/4885ALDH1A1 2724/4885

“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.