SCHEMBL6341820

SCHEMBL6341820

CC(C)(C)ONC(=O)C(O)C(C(N)=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.45
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
CYP2D6 P10635 1/20 0.39
CTSD P07339 1/20 0.38
BCAT2 O15382 1/20 0.37
TNF P01375 1/20 0.37
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP3 P08254 1/20 0.37
ADAM17 P78536 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ADRB3 P13945 3/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 1/20 0.36
NAAA Q02083 2/20 0.35
EPHX1 P07099 1/20 0.35

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
SCHEMBL6344345 0.83 KMT2A (0.53) KMT2ACYP2D6CTSDBCAT2SMN1; SMN2
SCHEMBL6342212 0.81 LMNA (0.46) KMT2ACYP2D6CTSDBCAT2TNF
SCHEMBL6341887 0.79 HDAC1 (0.53) KMT2ACYP2D6CTSDBCAT2TNF
SCHEMBL8675411 0.79 HDAC1 (0.53) KMT2ACYP2D6CTSDBCAT2TNF
SCHEMBL2345423 0.78 CTSS (0.43) KMT2ACTSSCTSKCYP2D6CTSD
SCHEMBL6212590 0.77 KMT2A (0.46) KMT2ACYP2D6CTSDBCAT2SMN1; SMN2
SCHEMBL6351480 0.74 BACE1 (0.43) KMT2ACYP2D6CTSDBCAT2NAAA
SCHEMBL17664442 0.73 CTSS (0.45) KMT2ACTSSCTSKATML3MBTL1
SCHEMBL31242992 0.72 CYP2D6 (0.64) KMT2ACYP2D6CTSDSMN1; SMN2L3MBTL1
SCHEMBL6052959 0.71 CYP2D6 (0.44) KMT2ACYP2D6LMNAEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6846820-B2 For therapy of diabetes, hyperglycemia, hypercholesterolemia, hypertension, hyperinsulinemias, hyperlipidemia, atherosclerosis and myocardial ischemia in mammals PFIZER INC. (US) 2005-01-25 US disclosed
US-6649634-B2 Use in treating diabetes, hyperglycemia, hypercholesterolemia, hypertension, hyperinsulinemias, hyperlipidemia, atherosclerosis and myocardial ischemia in mammals PFIZER, INC. 2003-11-18 US disclosed
US-20020028810-A1 Use in treating diabetes, hyperglycemia, hypercholesterolemia, hypertension, hyperinsulinemias, hyperlipidemia, atherosclerosis and myocardial ischemia in mammals HOOVER DENNIS J (US) 2002-03-07 US disclosed
US-6297269-B1 Substituted n-(indole-2-carbonyl-) amides and derivatives as glycogen phosphorylase inhibitors PFIZER INC. 2001-10-02 US disclosed
EP-0832066-B1 SUBSTITUTED N-(INDOLE-2-CARBONYL-) AMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER (US) 2001-09-12 EP disclosed
EP-0832066-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL-) AMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER INC. (US) 1998-04-01 EP disclosed
WO-1996039385-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL-) AMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER INC. (US) 1996-12-12 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-20020028810-A1 Use in treating diabetes, hyperglycemia, hypercholesterolemia, hypertension, hyperinsulinemias, hyperlipidemia, atherosclerosis and myocardial ischemia in mammals PYGL, GPR119, PYGM KMT2A 2221/4885CTSS 2125/4885CTSK 2876/4885

“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.