SCHEMBL587137

SCHEMBL587137

CC(NS(=O)(=O)c1ccc(Cl)cc1)C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.57
CA1 P00915 4/20 0.57
CA12 O43570 3/20 0.52
CA9 Q16790 3/20 0.52
CA14 Q9ULX7 3/20 0.52
CA3 P07451 1/20 0.52
CA4 P22748 1/20 0.52
CA6 P23280 1/20 0.52
CA5A P35218 1/20 0.52
CA7 P43166 1/20 0.52
CA13 Q8N1Q1 1/20 0.52
CA5B Q9Y2D0 1/20 0.52
MMP2 P08253 6/20 0.50
MMP1 P03956 3/20 0.50
MMP9 P14780 3/20 0.50
MMP13 P45452 3/20 0.50
MMP3 P08254 2/20 0.50
MMP7 P09237 2/20 0.50
MMP8 P22894 3/20 0.49
MMP14 P50281 1/20 0.49

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
SCHEMBL587136 1.00 CA2 (0.57) CA2CA1CA12CA9CA14
SCHEMBL17760488 0.82 SMN1; SMN2 (0.53) CA2CA1CA12CA9CA14
SCHEMBL8511437 0.82 SMN1; SMN2 (0.53) CA2CA1CA12CA9CA14
SCHEMBL8510543 0.82 SMN1; SMN2 (0.53) CA2CA1CA12CA9CA14
SCHEMBL16852445 0.80 FLT1 (0.45) ALDH1A1
SCHEMBL578878 0.80 SMN1; SMN2 (0.51) CA2CA1ALDH1A1
SCHEMBL578877 0.80 SMN1; SMN2 (0.51) CA2CA1ALDH1A1
SCHEMBL9880035 0.80 SMN1; SMN2 (0.51) CA2CA1ALDH1A1
SCHEMBL7909439 0.80 CA2 (0.61) CA2CA1CA12CA9CA14
SCHEMBL18077978 0.79 ALDH1A1 (0.43) CA2CA1MMP7ALDH1A1S1PR1

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-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
EP-2417133-A1 COMPOUNDS AND METHODS FOR ANTIVIRAL TREATMENT PTC Therapeutics, Inc. (US) 2012-02-15 EP disclosed
WO-2010117935-A1 COMPOUNDS AND METHODS FOR ANTIVIRAL TREATMENT SCHERING CORPORATION (US) 2010-10-14 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 (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 4664/4885CA12 3889/4885

“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.