SCHEMBL4119867

SCHEMBL4119867

COc1cccc(S(=O)(=O)c2sc(CCNC(=O)O)nc2-c2ccccc2F)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.41
GAA P10253 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KAT6A Q92794 1/20 0.40
PTGDR2 Q9Y5Y4 2/20 0.38
HTT P42858 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 2/20 0.37
DHODH Q02127 1/20 0.37
CLK1 P49759 1/20 0.37
CTSA P10619 1/20 0.36
NAMPT P43490 1/20 0.36
MTNR1B P49286 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL4137731 0.89 NFE2L2 (0.38) PTGDR2NAMPTMTNR1B
SCHEMBL4118513 0.88 MAPT (0.37) MAPTGAASMN1; SMN2HTTTP53
SCHEMBL4129177 0.86 KAT6A (0.39) MAPTGAASMN1; SMN2KAT6AHTT
SCHEMBL4119401 0.85 KAT6A (0.44) MAPTGAASMN1; SMN2KAT6AHTT
SCHEMBL3653735 0.83 TAS2R14 (0.39) MAPTGAAKAT6APTGDR2CLK1
Hydrochloric Acid SCHEMBL3648331 0.83 MAPT (0.40) MAPTGAASMN1; SMN2KAT6APTGDR2
SCHEMBL4118179 0.82 HTR6 (0.37) MAPTSMN1; SMN2HTTLMNATP53
SCHEMBL4132297 0.82 KMT2A (0.39) GAASMN1; SMN2TP53NAMPTMEN1
SCHEMBL3650714 0.82 NFE2L2 (0.39) MAPTGAAKAT6APTGDR2LMNA
SCHEMBL4137545 0.81 PKM (0.43) SMN1; SMN2HTTLMNATP53ALDH1A1

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
EP-2190822-B1 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2014-12-31 EP disclosed
US-20090156642-A1 5-Membered heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 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-20090156642-A1 5-Membered heterocyclic compound CEL, PGA5, COG5 MAPT 4258/4885GAA 7/4885SMN1; SMN2 4327/4885

“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.