SCHEMBL864099

SCHEMBL864099

CC(C)(C)OC(=O)NC(Cc1ccc(OS(=O)(=O)C(F)(F)F)cc1F)C(=O)N1CCC(F)(F)C1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 7/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
KMT2A Q03164 2/20 0.39
MC4R P32245 1/20 0.39
PTPN1 P18031 1/20 0.37
HRH2 P25021 1/20 0.37
HRH1 P35367 1/20 0.37
PABPC1 P11940 1/20 0.37
MAPK1 P28482 1/20 0.36
SCN9A Q15858 2/20 0.36
SCN10A Q9Y5Y9 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 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
SCHEMBL864098 1.00 P2RX7 (0.40) P2RX7CTSSCTSKKMT2AMC4R
SCHEMBL864372 0.88 P2RX7 (0.45) P2RX7CTSSCTSKKMT2AMC4R
SCHEMBL865637 0.85 MC4R (0.42) CTSSCTSKKMT2AMC4RPTPN1
SCHEMBL865636 0.85 MC4R (0.42) CTSSCTSKKMT2AMC4RPTPN1
SCHEMBL864596 0.84 KMT2A (0.42) P2RX7CTSSCTSKKMT2AMC4R
SCHEMBL864594 0.84 KMT2A (0.42) P2RX7CTSSCTSKKMT2AMC4R
SCHEMBL865127 0.84 DPP4 (0.36) P2RX7KMT2AHRH2HRH1
SCHEMBL864595 0.84 KMT2A (0.42) P2RX7CTSSCTSKKMT2AMC4R
SCHEMBL865128 0.84 DPP4 (0.36) P2RX7KMT2AHRH2HRH1
SCHEMBL2890943 0.82 CTSS (0.47) CTSSCTSKKMT2APTPN1SCN9A

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-20120077793-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-03-29 US disclosed
EP-2406247-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS Prosidion Limited (GB) 2012-01-18 EP disclosed
WO-2010103333-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2010-09-16 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-20120077793-A1 Compounds for the Treatment of Metabolic Disorders GPR119, GPR132, FFAR2 P2RX7 1189/4885CTSS 2448/4885CTSK 2018/4885

“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.