SCHEMBL864596

SCHEMBL864596

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

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
PABPC1 P11940 1/20 0.42
SCN9A Q15858 4/20 0.40
P2RX7 Q99572 2/20 0.40
MAPK1 P28482 1/20 0.40
HRH2 P25021 1/20 0.40
HRH1 P35367 1/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
DPP4 P27487 3/20 0.39
DPP7 Q9UHL4 3/20 0.39
DPP9 Q86TI2 2/20 0.39
MEN1 O00255 1/20 0.39
MC4R P32245 1/20 0.39

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
SCHEMBL864595 1.00 KMT2A (0.42) KMT2APABPC1SCN9AP2RX7MAPK1
SCHEMBL864594 1.00 KMT2A (0.42) KMT2APABPC1SCN9AP2RX7MAPK1
SCHEMBL864372 0.89 P2RX7 (0.45) KMT2APABPC1P2RX7MAPK1HRH2
SCHEMBL864782 0.85 KMT2A (0.45) KMT2APABPC1SCN9AMAPK1CTSS
SCHEMBL864784 0.85 KMT2A (0.45) KMT2APABPC1SCN9AMAPK1CTSS
SCHEMBL864783 0.85 KMT2A (0.45) KMT2APABPC1SCN9AMAPK1CTSS
SCHEMBL864098 0.84 P2RX7 (0.40) KMT2APABPC1SCN9AP2RX7MAPK1
SCHEMBL864099 0.84 P2RX7 (0.40) KMT2APABPC1SCN9AP2RX7MAPK1
SCHEMBL864370 0.82 XIAP (0.46)
SCHEMBL13160627 0.82 XIAP (0.46)

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 KMT2A 2799/4885PABPC1 4433/4885SCN9A 3146/4885

“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.