SCHEMBL4814288

SCHEMBL4814288

CS(=O)(=O)OCc1ccc2c(c1)C(=O)CC2

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.47
MAOA P21397 6/20 0.43
MAOB P27338 6/20 0.43
IL4I1 Q96RQ9 1/20 0.40
PTGS2 P35354 5/20 0.40
HRH3 Q9Y5N1 2/20 0.38
BRD4 O60885 2/20 0.38
AKR1B1 P15121 1/20 0.35

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
SCHEMBL4816161 0.88 MAOB (0.46) MAOAMAOBHRH3AKR1B1
SCHEMBL4811875 0.85 PBRM1 (0.41) PBRM1MAOAMAOBIL4I1PTGS2
SCHEMBL5175162 0.76 PBRM1 (0.44) PBRM1MAOAMAOBIL4I1PTGS2
SCHEMBL1512782 0.75 PBRM1 (0.53) PBRM1MAOAMAOBIL4I1PTGS2
SCHEMBL27951808 0.75 PBRM1 (0.50) PBRM1MAOAMAOBIL4I1HRH3
SCHEMBL4808718 0.75 PTGS2 (0.40) PBRM1MAOAMAOBPTGS2
SCHEMBL4817719 0.75 MAOA (0.32) MAOAMAOB
SCHEMBL4816674 0.74 MAOB (0.44) MAOAMAOBPTGS2HRH3
SCHEMBL4815186 0.74 PTGS2 (0.41) PBRM1MAOAMAOBPTGS2
SCHEMBL4807990 0.74 PTGS2 (0.32) MAOAMAOBPTGS2

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
EP-1740579-B1 TRICYCLIC PYRAZOLE KINASE INHIBITORS ABBVIE INC (US) 2015-08-19 EP disclosed
US-7468371-B2 Tricyclic pyrazole kinase inhibitors ABBOTT LABORATORIES INC. (US) 2008-12-23 US disclosed
US-20060014816-A1 Tricyclic pyrazole kinase inhibitors ABBVIE INC. 2006-01-19 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-20060014816-A1 Tricyclic pyrazole kinase inhibitors PRKDC, PRKACA, PIK3C3 PBRM1 988/4885MAOA 1625/4885MAOB 1261/4885

“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.