SCHEMBL4125938

SCHEMBL4125938

CN(Cc1cc(-c2cccnc2F)c(S(=O)(=O)c2ncc[nH]2)s1)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.34
LIPG Q9Y5X9 2/20 0.32
LIPC P11150 1/20 0.31
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 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
SCHEMBL3690486 0.88 PDK2 (0.34) FFAR4
SCHEMBL3690491 0.87 FFAR4 (0.32) FFAR4
SCHEMBL4125901 0.85 NAMPT (0.35) LIPGLIPC
SCHEMBL4117657 0.83 GPBAR1 (0.33) FFAR4LIPGLIPC
SCHEMBL4127364 0.83 MAOA (0.36) LIPGLIPC
Hydrochloric Acid SCHEMBL3703108 0.83 PDK2 (0.31)
SCHEMBL4125945 0.82 LIPG (0.33) FFAR4LIPGLIPC
SCHEMBL4125599 0.82 LIPG (0.33) LIPGLIPC
SCHEMBL3782033 0.82 NAMPT (0.37)
SCHEMBL3649326 0.82 HTR6 (0.39)

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 FFAR4 224/4885LIPG 2467/4885LIPC 83/4885

“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.