SCHEMBL2849453

SCHEMBL2849453

Cc1cc(NS(=O)(=O)c2ccc(-c3ccc(F)cc3)nc2)ccc1CN1CCN(C(=O)O)[C@@H](C)C1

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MLNR O43193 6/20 0.73
KCNH2 Q12809 2/20 0.50
MGLL Q99685 2/20 0.44
FAAH O00519 1/20 0.42
PTGDR2 Q9Y5Y4 2/20 0.37
RORC P51449 2/20 0.37
KMT2A Q03164 1/20 0.37
ENPP2 Q13822 1/20 0.37
SETD7 Q8WTS6 1/20 0.36
CCR1 P32246 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
SCHEMBL2851975 0.90 MLNR (0.74) MLNRKCNH2MGLLPTGDR2
SCHEMBL1999247 0.90 MLNR (0.67) MLNRKCNH2MGLLFAAHSETD7
SCHEMBL2853455 0.88 MLNR (0.69) MLNRKCNH2MGLLPTGDR2KMT2A
SCHEMBL2853558 0.87 MLNR (0.72) MLNRKCNH2MGLLFAAHPTGDR2
SCHEMBL2851448 0.86 MLNR (0.52) MLNRKCNH2MGLLFAAHPTGDR2
SCHEMBL1999285 0.84 MLNR (1.00) MLNR
SCHEMBL2003109 0.81 MLNR (0.69) MLNRKCNH2MGLLPTGDR2SETD7
SCHEMBL1999248 0.81 MLNR (0.60) MLNRKCNH2RORCKMT2ASETD7
SCHEMBL2853551 0.79 MLNR (0.53) MLNRKCNH2MGLLFAAHPTGDR2
SCHEMBL3659038 0.79 MLNR (0.53) MLNRKCNH2PTGDR2KMT2ACCR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100256364-A1 PIPERAZINYL-SULFONAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF GPR38 RECEPTOR MEDIATED DISEASES GLAXO GROUP LTD. 2010-10-07 US disclosed
EP-2212299-A1 PIPERAZINYL-SULFONAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF GPR38 RECEPTOR MEDIATED DISEASES Glaxo Group Limited (GB) 2010-08-04 EP disclosed
WO-2009068552-A1 PIPERAZINYL-SULFONAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF GPR38 RECEPTOR MEDIATED DISEASES GLAXO GROUP LIMITED (GB) 2009-06-04 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-20100256364-A1 PIPERAZINYL-SULFONAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF GPR38 RECEPTOR MEDIATED DISEASES GPR68, GPR88, GIPR MLNR 12/4885KCNH2 2812/4885MGLL 1048/4885

“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.