SCHEMBL5423939

SCHEMBL5423939

CS(=O)(=O)c1ccc(C(=O)N[C@H](C(=O)O)C2CCCCC2)c(N)c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PYGL P06737 16/20 0.46
KMT2A Q03164 2/20 0.43
CYP2C9 P11712 3/20 0.43
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP3 P08254 1/20 0.43
MMP7 P09237 1/20 0.43
MMP13 P45452 1/20 0.43
MEN1 O00255 1/20 0.42
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41

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
SCHEMBL5194502 0.85 KMT2A (0.39) KMT2AMMP1MMP2MMP3MMP7
SCHEMBL5195896 0.84 ALDH1A1 (0.47) PYGLKMT2ACYP2C9MMP1MMP2
SCHEMBL5195886 0.84 ALDH1A1 (0.47) PYGLKMT2ACYP2C9MMP1MMP2
SCHEMBL5195691 0.83 PYGL (0.53) PYGLCYP2C9
SCHEMBL5195696 0.83 PYGL (0.53) PYGLCYP2C9
SCHEMBL5192292 0.81 PYGL (0.51) PYGLCYP2C9CNR1CNR2
SCHEMBL5192299 0.81 PYGL (0.51) PYGLCYP2C9CNR1CNR2
SCHEMBL5195449 0.81 PYGL (0.59) PYGLCYP2C9CNR1CNR2
SCHEMBL5194685 0.81 PYGL (0.46) PYGLCYP2C9CNR1CNR2
SCHEMBL5197270 0.81 PYGL (0.46) PYGLCYP2C9CNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070249670-A1 Glycogen Phosphorylase Inhibitor Compounds and Pharmaceutical Compositions Thereof SMITHKLINE BEECHAM CORPORATION (US) 2007-10-25 US 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-20070249670-A1 Glycogen Phosphorylase Inhibitor Compounds and Pharmaceutical Compositions Thereof PYGM, PYGL, GYS1 PYGL 2/4885KMT2A 4148/4885CYP2C9 2982/4885

“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.