SCHEMBL8510599

SCHEMBL8510599

NS(=O)(=O)c1ccccc1C(CF)CF

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 14/20 0.45
CA1 P00915 12/20 0.45
CA9 Q16790 9/20 0.45
CA12 O43570 6/20 0.45
CA6 P23280 4/20 0.45
CA5A P35218 4/20 0.45
CA4 P22748 3/20 0.45
CA7 P43166 3/20 0.45
CA5B Q9Y2D0 3/20 0.45
CA14 Q9ULX7 2/20 0.45
CYP2C9 P11712 1/20 0.45
LDHA P00338 1/20 0.36
CDK2 P24941 1/20 0.36
PTGES2 Q9H7Z7 3/20 0.36
CA3 P07451 1/20 0.35
PLA2G7 Q13093 1/20 0.35
CA13 Q8N1Q1 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
SCHEMBL28268066 0.81 CA2 (0.45) CA2CA1CA9CA12CA6
SCHEMBL592599 0.80 CA2 (0.41) CA2CA1CA9CA12CA6
SCHEMBL29933194 0.78 CA2 (0.50) CA2CA1CA9CA12CA6
SCHEMBL21826752 0.78 CA2 (0.50) CA2CA1CA9CA12CA6
SCHEMBL9526615 0.76 CA1 (0.42) CA2CA1CA9CA12CA6
SCHEMBL6368622 0.75 CA1 (0.41) CA2CA1CA9CA12CA6
SCHEMBL2188655 0.74 CA2 (0.47) CA2CA1CA9CA12CA6
SCHEMBL3555914 0.74 CA2 (0.43) CA2CA1CA9CA12CA6
SCHEMBL17760496 0.74 CA2 (0.40) CA2CA1CA9CA12CA6
SCHEMBL1106519 0.74 CA1 (0.53) CA2CA1CA9CA12CA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9593108-B2 Compounds and methods for antiviral treatment PTC THERAPEUTICS, INC. (US) 2017-03-14 US disclosed
US-20120135999-A1 COMPOUNDS AND METHODS FOR ANTIVIRAL TREATMENT PTC THERAPEUTICS, INC. (US) 2012-05-31 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-20120135999-A1 COMPOUNDS AND METHODS FOR ANTIVIRAL TREATMENT EIF2AK2, MAVS, ZC3HAV1 CA2 3639/4885CA1 4664/4885CA9 3837/4885

“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.