SCHEMBL6289618

SCHEMBL6289618

Cc1ccc(-c2c(OCCO)nn(C)c2NS(=O)(=O)c2ccccn2)cc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 4/20 0.41
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
METAP2 P50579 1/20 0.37
GLO1 Q04760 5/20 0.37
KAT6A Q92794 1/20 0.36
EDNRB P24530 2/20 0.35
FPR1 P21462 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
SLC40A1 Q9NP59 1/20 0.34
HTR6 P50406 1/20 0.34

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
SCHEMBL6288919 0.90 METAP2 (0.37) EDNRAALDH1A1METAP2GLO1KAT6A
SCHEMBL6292781 0.88 EDNRA (0.43) EDNRAMEN1ALDH1A1POLBKMT2A
SCHEMBL6289637 0.86 EDNRB (0.42) EDNRAEDNRB
SCHEMBL6289312 0.83 EDNRA (0.40) EDNRAEDNRB
SCHEMBL6292805 0.79 EDNRA (0.67) EDNRAEDNRB
SCHEMBL6292752 0.78 EDNRA (0.40) EDNRAEDNRB
SCHEMBL6289662 0.78 EDNRA (0.57) EDNRAEDNRBFPR1
SCHEMBL6289275 0.77 EDNRA (0.56) EDNRAEDNRBFPR1
SCHEMBL6288942 0.76 EDNRA (0.55) EDNRAEDNRBFPR1
SCHEMBL7839449 0.76 MAPT (0.42) EDNRAMEN1ALDH1A1KMT2AFPR1

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 EDNRA 2/4885MEN1 1327/4885ALDH1A1 1527/4885

“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.