SCHEMBL2447766

SCHEMBL2447766

CS(=O)(=O)c1ccc2cccccc1-2

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 13/20 0.64
PTGS1 P23219 1/20 0.49
MAOA P21397 1/20 0.48
LOX P28300 1/20 0.48
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
RAB9A P51151 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
ACLY P53396 1/20 0.43
LOXL2 Q9Y4K0 1/20 0.42

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
SCHEMBL8658514 0.94 PTGS2 (0.62) PTGS2PTGS1MAOALOXKDM4E
SCHEMBL937206 0.93 PTGS2 (0.61) PTGS2PTGS1MAOALOXKDM4E
SCHEMBL29415408 0.93 PTGS2 (0.61) PTGS2PTGS1MAOALOXKDM4E
Hydrochloric Acid SCHEMBL7352630 0.91 PTGS2 (0.59) PTGS2PTGS1MAOALOXKDM4E
SCHEMBL4198455 0.85 PTGS2 (0.62) PTGS2PTGS1KDM4EALDH1A1RAB9A
SCHEMBL7265178 0.83 PTGS2 (0.50) PTGS2MAOALOXKDM4EALDH1A1
SCHEMBL5711493 0.82 PTGS2 (0.52) PTGS2PTGS1ALDH1A1RAB9AL3MBTL1
SCHEMBL6801877 0.82 PTGS2 (0.49) PTGS2KDM4EALDH1A1RAB9A
SCHEMBL6904881 0.82 PTGS2 (0.68) PTGS2PTGS1MAOALOXKDM4E
SCHEMBL4884912 0.82 PTGS2 (0.53) PTGS2PTGS1MAOALOXL3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8575153-B2 Pyridine-3-carboxyamide derivative KOWA COMPANY, LTD. (JP) 2013-11-05 US disclosed
EP-2380877-A1 PYRIDINE-3-CARBOXYAMIDE DERIVATIVE Kowa Company, Ltd. (JP) 2011-10-26 EP disclosed
US-20110237590-A1 PYRIDINE-3-CARBOXYAMIDE DERIVATIVE KOWA COMPANY, LTD. (JP) 2011-09-29 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 (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-20110237590-A1 PYRIDINE-3-CARBOXYAMIDE DERIVATIVE JAK3, JAK1, UACA PTGS2 791/4885PTGS1 294/4885MAOA 2829/4885

“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.