SCHEMBL3704869

SCHEMBL3704869

Cc1ccc(S(=O)(=O)c2cc(CCNC(=O)O)nn2-c2cccc(F)c2Cl)cn1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 5/20 0.37
NAMPT P43490 9/20 0.36
PTGS2 P35354 4/20 0.34
EPHX2 P34913 3/20 0.34
KMT2A Q03164 1/20 0.33
RORC P51449 1/20 0.32

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
SCHEMBL4131144 0.92 NAMPT (0.37) P2RX7NAMPTPTGS2EPHX2KMT2A
SCHEMBL4125823 0.92 NAMPT (0.38) P2RX7NAMPTPTGS2EPHX2
SCHEMBL4135640 0.91 NAMPT (0.37) P2RX7NAMPTPTGS2EPHX2
SCHEMBL4130432 0.91 NAMPT (0.39) NAMPTPTGS2EPHX2
SCHEMBL4119630 0.90 RIPK1 (0.38) P2RX7NAMPTPTGS2EPHX2KMT2A
SCHEMBL4135433 0.89 NAMPT (0.37) NAMPT
SCHEMBL4136915 0.88 NAMPT (0.37) NAMPTPTGS2EPHX2
SCHEMBL4135868 0.88 NAMPT (0.39) NAMPTPTGS2EPHX2KMT2A
SCHEMBL4131518 0.87 SCN9A (0.37) P2RX7NAMPTPTGS2EPHX2KMT2A
SCHEMBL4129210 0.85 P2RX7 (0.37) P2RX7NAMPTPTGS2

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 5 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
EP-2190822-A2 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2010-06-02 EP disclosed
WO-2009041705-A9 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2009-08-13 WO disclosed
US-20090156642-A1 5-Membered heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 US disclosed
WO-2009041705-A2 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-04-02 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-20090156642-A1 5-Membered heterocyclic compound CEL, PGA5, COG5 P2RX7 1303/4885NAMPT 2129/4885PTGS2 269/4885

“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.