SCHEMBL4155342

SCHEMBL4155342

O=C(O)CCc1c[nH]c2c(=O)[nH]c3ccc(S(=O)(=O)Nc4cccc(O)c4)cc3c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.41
SIRT6 Q8N6T7 1/20 0.41
PKM P14618 3/20 0.40
KMT2A Q03164 2/20 0.40
HSD17B2 P37059 1/20 0.40
GAA P10253 1/20 0.39
AR P10275 1/20 0.39
BRD4 O60885 4/20 0.39
MAPT P10636 3/20 0.39
POLB P06746 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
BRAF P15056 1/20 0.39
PDE3A Q14432 1/20 0.39
PARP1 P09874 1/20 0.38
UQCRB P14927 1/20 0.38
TP53 P04637 2/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
HTR6 P50406 1/20 0.37

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
SCHEMBL4163279 0.92 PKM (0.48) SIRT2SIRT6PKMGAAAR
SCHEMBL4162699 0.90 BRD4 (0.47) SIRT2SIRT6PKMKMT2ABRD4
SCHEMBL4162432 0.90 MAPT (0.47) SIRT2SIRT6PKMKMT2AMAPT
SCHEMBL4153950 0.90 PKM (0.50) PKMGAAARBRD4MAPT
SCHEMBL4164325 0.88 POLB (0.53) PKMKMT2AGAABRD4MAPT
SCHEMBL4158099 0.86 BRD4 (0.54) BRD4PDE3AHTR6
SCHEMBL4161015 0.86 SIRT2 (0.42) SIRT2SIRT6PKMKMT2AGAA
SCHEMBL4166792 0.86 PTGDR2 (0.41) SIRT2SIRT6PKMGAAAR
SCHEMBL4161137 0.86 POLB (0.50) PKMKMT2AGAAARBRD4
SCHEMBL4167129 0.86 POLB (0.41) PKMKMT2AGAAARBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8426437-B2 Pyrroloquinoline derivatives and their use as protein kinases inhibitors PIERRE FABRE MEDICAMENT (FR) 2013-04-23 US claimed
US-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors PIERRE FABRE MEDICAMENT (FR) 2009-02-12 US claimed
US-8426437-B2 Pyrroloquinoline derivatives and their use as protein kinases inhibitors PIERRE FABRE MEDICAMENT (FR) 2013-04-23 US disclosed
US-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors PIERRE FABRE MEDICAMENT (FR) 2009-02-12 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-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors MAP3K1, MAP3K2, MAP3K7 SIRT2 1911/4885SIRT6 2081/4885PKM 276/4885

“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.