SCHEMBL3586423

SCHEMBL3586423

CC(C)(C)[Si](C)(C)OCc1ccc(CS(N)(=O)=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 12/20 0.43
CA9 Q16790 9/20 0.43
CA1 P00915 8/20 0.43
CA5A P35218 3/20 0.43
KIF11 P52732 1/20 0.41
CA12 O43570 3/20 0.39
KMT2A Q03164 1/20 0.35
CA14 Q9ULX7 3/20 0.33
CA7 P43166 2/20 0.33
PREP P48147 1/20 0.32
AGXT P21549 1/20 0.32
BACE1 P56817 1/20 0.32
DUT P33316 2/20 0.31
LMNA P02545 1/20 0.31
CA3 P07451 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
MAOB P27338 1/20 0.31
CA13 Q8N1Q1 1/20 0.31
CA5B Q9Y2D0 1/20 0.31

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
SCHEMBL16369618 0.84 CA2 (0.59) CA2CA9CA1CA5ACA12
SCHEMBL2882144 0.79 CA2 (0.40) CA2CA9CA1CA12KMT2A
SCHEMBL18954528 0.78 MAOB (0.41) AGXTMAOB
SCHEMBL133816 0.78 MAOB (0.39) AGXTMAOB
SCHEMBL835705 0.77 CA2 (0.39) CA2CA9CA1CA12KMT2A
SCHEMBL12855670 0.75 AGXT (0.52) CA2CA9CA1AGXTMAOB
SCHEMBL906834 0.75 IDO1 (0.48) KMT2ABACE1LMNA
SCHEMBL15489965 0.75 TDP1 (0.37) KMT2AAGXTBACE1DUT
SCHEMBL16400659 0.75 MAOB (0.39) CA2CA9CA1CA12CA14
SCHEMBL3426875 0.74 AGXT (0.32) AGXTBACE1DUT

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-20100069350-A1 New Pyridine Analogues III ASTRAZENECA AB (SE) 2010-03-18 US disclosed
EP-2044050-A1 NEW PYRIDINE ANALOGUES Astra Zeneca AB (SE) 2009-04-08 EP disclosed
US-20080039437-A1 New Pyridine Analogues III ASTRAZENECA AB (SE) 2008-02-14 US disclosed
WO-2008004946-A1 NEW PYRIDINE ANALOGUES ASTRAZENECA AB (SE) 2008-01-10 WO 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 (2 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-20080039437-A1 New Pyridine Analogues III P2RY12, P2RY1, P2RY11 CA2 3764/4885CA9 4563/4885CA1 4845/4885
US-20100069350-A1 New Pyridine Analogues III P2RY12, P2RY11, P2RY1 CA2 2580/4885CA9 3962/4885CA1 4624/4885

“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.