SCHEMBL6428040

SCHEMBL6428040

CCc1cccc(S(N)(=O)=O)c1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.44
CA1 P00915 7/20 0.44
CA9 Q16790 6/20 0.44
CA12 O43570 4/20 0.44
CA4 P22748 4/20 0.41
CA6 P23280 4/20 0.41
CA5A P35218 3/20 0.41
CA7 P43166 3/20 0.41
CA14 Q9ULX7 3/20 0.41
CA5B Q9Y2D0 3/20 0.41
CYP2C9 P11712 1/20 0.41
CA3 P07451 2/20 0.41
CA13 Q8N1Q1 2/20 0.41
PLA2G7 Q13093 1/20 0.41
PTGES2 Q9H7Z7 1/20 0.40
STAT3 P40763 1/20 0.40
MT-CO2 P00403 1/20 0.39
LMNA P02545 1/20 0.39
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39

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
SCHEMBL30296205 0.85 CA1 (0.38) CA2CA1CA9CA12CA4
SCHEMBL17258810 0.83 TAAR1 (0.42) CA2CA1CA9CA12CA4
SCHEMBL3853253 0.83 CA1 (0.50) CA2CA1CA9CA12CA14
SCHEMBL27895889 0.83 CA2 (0.52) CA2CA1CA9CA12CA4
SCHEMBL6700703 0.81 CA2 (0.40) CA2CA1CA9CA12STAT3
SCHEMBL4759798 0.80 CASP1 (0.48) CA2CA1CA9CA12CA4
SCHEMBL301742 0.79 CA2 (0.52) CA2CA1CA9CA12CA4
SCHEMBL30096522 0.79 CA2 (0.52) CA2CA1CA9CA12CA4
SCHEMBL6111189 0.79 CA1 (0.45) CA2CA1CA9CA12CA4
SCHEMBL8976123 0.77 CA2 (0.52) CA2CA1CA9CA12CA4

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-10022376-B2 Pyrazolopyridines and pyrazolopyrimidines PFIZER INC. (US) 2018-07-17 US disclosed
US-20170071946-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES PFIZER INC. (US) 2017-03-16 US disclosed
US-9518052-B2 Pyrazolopyridines and pyrazolopyrimidines PFIZER INC. (US) 2016-12-13 US disclosed
US-20150329542-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES PFIZER INC. 2015-11-19 US disclosed
US-6967196-B1 Sulfonamide compounds and uses thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2005-11-22 US 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 (3 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-10022376-B2 Pyrazolopyridines and pyrazolopyrimidines CBR3, HRH4, REN CA2 358/4885CA1 2503/4885CA9 1800/4885
US-20150329542-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES HRH2, HRH4, HRH1 CA2 361/4885CA1 2724/4885CA9 1782/4885
US-20170071946-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES HRH2, HRH4, HRH1 CA2 361/4885CA1 2724/4885CA9 1782/4885

“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.