SCHEMBL6289623

SCHEMBL6289623

CC(=O)OCCOc1c(-c2ccc(C)cc2)c(N(S(=O)(=O)c2ccc(C(C)(C)C)cc2)S(=O)(=O)c2ccc(C(C)(C)C)cc2)nn1C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 8/20 0.40
EDNRA P25101 1/20 0.40
LMNA P02545 3/20 0.37
CYP3A4 P08684 1/20 0.37
GAA P10253 1/20 0.37
CYP2C9 P11712 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP2C19 P33261 1/20 0.37
HCRTR2 O43614 1/20 0.37
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33

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
SCHEMBL6293046 0.84 EDNRA (0.44) EDNRBEDNRALMNAHCRTR2
SCHEMBL6288912 0.77 EDNRB (0.40) EDNRBEDNRAGAAMAPK1
SCHEMBL6293264 0.76 EDNRB (0.39) EDNRBEDNRALMNAHCRTR2
SCHEMBL6289632 0.75 EDNRA (0.54) EDNRBEDNRA
SCHEMBL6293259 0.72 EDNRA (0.44) EDNRBEDNRAHCRTR2
SCHEMBL6289659 0.72 EDNRA (0.42) EDNRBEDNRALMNA
SCHEMBL6292808 0.71 EDNRA (0.67) EDNRBEDNRA
SCHEMBL6289699 0.71 EDNRA (0.43) EDNRBEDNRAHCRTR2
SCHEMBL6288940 0.69 EDNRA (0.41) EDNRBEDNRALMNA
SCHEMBL6289771 0.69 KEAP1 (0.36) EDNRBEDNRA

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
US-6962923-B2 Pyrazole compositions PFIZER INC. (US) 2005-11-08 US disclosed
US-20030232848-A1 Pyrazole compositions PFIZER INC. 2003-12-18 US disclosed
US-6573270-B1 Endothelin receptor antagonists PFIZER INC. 2003-06-03 US disclosed
EP-1072597-A1 Pyrazoles and their use as endothelin antagonists Pfizer Limited (GB) 2001-01-31 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-20030232848-A1 Pyrazole compositions EDNRB, EDNRA, AGTR1 EDNRB 1/4885EDNRA 2/4885LMNA 2329/4885

“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.