SCHEMBL6289638

SCHEMBL6289638

COc1nn(C)c(NS(=O)(=O)c2ccc(C(C)C)cc2)c1-c1ccc2c(c1)OCO2

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
PKM P14618 1/20 0.44
KMT2A Q03164 1/20 0.44
EDNRB P24530 2/20 0.43
EDNRA P25101 2/20 0.43
PIK3CD O00329 1/20 0.43
HPGD P15428 1/20 0.41
USP2 O75604 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41

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
SCHEMBL6288968 0.92 MAPT (0.47) MAPTALDH1A1MEN1PKMKMT2A
SCHEMBL6292820 0.90 MAPT (0.57) MAPTALDH1A1MEN1PKMKMT2A
SCHEMBL6289686 0.89 MAPT (0.46) MAPTALDH1A1MEN1PKMKMT2A
SCHEMBL6288926 0.89 MAPT (0.46) MAPTALDH1A1MEN1PKMKMT2A
SCHEMBL6293072 0.87 MAPT (0.44) MAPTALDH1A1MEN1PKMKMT2A
SCHEMBL6289777 0.86 MAPT (0.44) MAPTALDH1A1MEN1PKMKMT2A
SCHEMBL6289308 0.86 MAPT (0.59) MAPTALDH1A1MEN1PKMKMT2A
SCHEMBL6288945 0.78 LMNA (0.38) MAPTEDNRBEDNRAPIK3CD
SCHEMBL6289631 0.77 EDNRA (0.41) MAPTALDH1A1MEN1PKMKMT2A
SCHEMBL6289621 0.76 EDNRA (0.48) ALDH1A1EDNRBEDNRA

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 MAPT 4430/4885ALDH1A1 1527/4885MEN1 1327/4885

“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.