SCHEMBL864231

SCHEMBL864231

CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)cc1F)C(=O)N1CCCC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MC4R P32245 1/20 0.47
CTSS P25774 2/20 0.45
CTSK P43235 2/20 0.45
KMT2A Q03164 3/20 0.44
PABPC1 P11940 1/20 0.43
SCN9A Q15858 4/20 0.42
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PTPN1 P18031 1/20 0.40
P2RX7 Q99572 1/20 0.40
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 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
SCHEMBL864232 1.00 MC4R (0.47) MC4RCTSSCTSKKMT2APABPC1
SCHEMBL864784 0.87 KMT2A (0.45) MC4RCTSSCTSKKMT2APABPC1
SCHEMBL864782 0.87 KMT2A (0.45) MC4RCTSSCTSKKMT2APABPC1
SCHEMBL864783 0.87 KMT2A (0.45) MC4RCTSSCTSKKMT2APABPC1
SCHEMBL865637 0.86 MC4R (0.42) MC4RCTSSCTSKKMT2APABPC1
SCHEMBL865636 0.86 MC4R (0.42) MC4RCTSSCTSKKMT2APABPC1
SCHEMBL864372 0.84 P2RX7 (0.45) MC4RCTSSCTSKKMT2APABPC1
SCHEMBL864800 0.83 PTPN1 (0.54) CTSSCTSKSCN9APTPN1
SCHEMBL30765042 0.83 PTPN1 (0.54) CTSSCTSKSCN9APTPN1
SCHEMBL864799 0.83 PTPN1 (0.54) CTSSCTSKSCN9APTPN1

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 6 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
US-20120077793-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-03-29 US disclosed
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
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 MC4R 51/4885CTSS 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.