SCHEMBL7121356

SCHEMBL7121356

Cc1c(S(=O)(=O)O)c(S(=O)(=O)O)c(C)c(S(=O)(=O)O)c1S(=O)(=O)O

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 2/20 0.37
FABP3 P05413 1/20 0.37
FABP5 Q01469 1/20 0.37
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CA5A P35218 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL28147772 0.90 FABP4 (0.36) FABP4FABP3FABP5KDM4EPOLB
SCHEMBL83879 0.87 FABP4 (0.36) FABP4FABP3FABP5KDM4EPOLB
SCHEMBL2862401 0.86 FABP4 (0.37) FABP4FABP3FABP5KDM4EPOLB
SCHEMBL2869222 0.83 FABP4 (0.38) FABP4FABP3FABP5KDM4EPOLB
SCHEMBL20025727 0.82 FABP3 (0.37) FABP4FABP3FABP5KDM4EPOLB
Ammonia Solution, Strong SCHEMBL9809148 0.80 FABP4 (0.36) FABP4FABP3FABP5KDM4EPOLB
Hydrochloric Acid SCHEMBL11010689 0.80 FABP4 (0.36) FABP4FABP3FABP5KDM4EPOLB
SCHEMBL9404146 0.80 FABP3 (0.31) FABP4FABP3FABP5
SCHEMBL2869064 0.80 CA1 (0.41) FABP4FABP3FABP5KDM4EPOLB
SCHEMBL863101 0.78 FABP3 (0.34) FABP4FABP3FABP5

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-6670474-B2 Such as bis-1,2-(2-(2,3-epoxypropyl)phenoxy)ethane; chemical intermediates for formation of epoxy resins PEWS R GARTH (US) 2003-12-30 US claimed
US-20020151731-A1 Novel epoxide derivatives of allylarylphenols PEWS R GARTH (US) 2002-10-17 US claimed

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-20020151731-A1 Novel epoxide derivatives of allylarylphenols EPHX2, CBR3, CYP4X1 FABP4 1450/4885FABP3 3347/4885FABP5 1221/4885

“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.